data_1J59

#

_entry.id 1J59

#

_audit_conform.dict_name mmcif_pdbx.dic

_audit_conform.dict_version 1.0670

_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic

#

loop_

_database_2.database_id

_database_2.database_code

PDB 1J59

NDB PD0299

RCSB RCSB001694

#

loop_

_database_PDB_rev.num

_database_PDB_rev.date

_database_PDB_rev.date_original

_database_PDB_rev.status

_database_PDB_rev.replaces

_database_PDB_rev.mod_type

1 2002-03-01 2002-03-01 ? 1J59 0

2 2003-04-01 ? ? 1J59 1

3 2009-02-24 ? ? 1J59 1

#

loop_

_database_PDB_rev_record.rev_num

_database_PDB_rev_record.type

_database_PDB_rev_record.details

2 JRNL ?

3 VERSN ?

#

_pdbx_database_PDB_obs_spr.id SPRSDE

_pdbx_database_PDB_obs_spr.pdb_id 1J59

_pdbx_database_PDB_obs_spr.replace_pdb_id 1BER

_pdbx_database_PDB_obs_spr.date 2002-03-01

#

_pdbx_database_status.status_code REL

_pdbx_database_status.entry_id 1J59

_pdbx_database_status.deposit_site RCSB

_pdbx_database_status.process_site RCSB

_pdbx_database_status.SG_entry .

#

loop_

_audit_author.name

_audit_author.pdbx_ordinal

'Parkinson, G.' 1

'Wilson, C.' 2

'Gunasekera, A.' 3

'Ebright, Y.W.' 4

'Ebright, R.H.' 5

'Berman, H.M.' 6

#

_citation.id primary

_citation.title

'Structure of the CAP-DNA complex at 2.5 angstroms resolution: a complete picture of the protein-DNA interface.'

_citation.journal_abbrev J.Mol.Biol.

_citation.journal_volume 260

_citation.page_first 395

_citation.page_last 408

_citation.year 1996

_citation.journal_id_ASTM JMOBAK

_citation.country UK

_citation.journal_id_ISSN 0022-2836

_citation.journal_id_CSD 0070

_citation.book_publisher ?

_citation.pdbx_database_id_PubMed 8757802

_citation.pdbx_database_id_DOI 10.1006/jmbi.1996.0409

#

loop_

_citation_author.citation_id

_citation_author.name

_citation_author.ordinal

primary 'Parkinson, G.' 1

primary 'Wilson, C.' 2

primary 'Gunasekera, A.' 3

primary 'Ebright, Y.W.' 4

primary 'Ebright, R.E.' 5

primary 'Berman, H.M.' 6

#

_cell.entry_id 1J59

_cell.length_a 136.990

_cell.length_b 152.800

_cell.length_c 76.060

_cell.angle_alpha 90.00

_cell.angle_beta 90.00

_cell.angle_gamma 90.00

_cell.Z_PDB 16

_cell.pdbx_unique_axis ?

#

_symmetry.entry_id 1J59

_symmetry.space_group_name_H-M 'C 2 2 21'

_symmetry.pdbx_full_space_group_name_H-M ?

_symmetry.cell_setting ?

_symmetry.Int_Tables_number ?

#

loop_

_entity.id

_entity.type

_entity.src_method

_entity.pdbx_description

_entity.formula_weight

_entity.pdbx_number_of_molecules

_entity.details

1 polymer syn "5'-D(*GP*CP*GP*AP*AP*AP*AP*GP*TP*GP*TP*GP*AP*C)-3'" 4353.889 2 ?

2 polymer syn

;5'-D(*AP*TP*AP*TP*GP*TP*CP*AP*CP*AP*CP*TP*TP*TP*TP*CP*G )-3'

;

5152.401 2 ?

3 polymer man 'CATABOLITE GENE ACTIVATOR PROTEIN (CAP)' 23541.408 2 ?

4 non-polymer syn "ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE" 329.208 2 ?

5 water nat water 18.015 286 ?

#

loop_

_entity_poly.entity_id

_entity_poly.type

_entity_poly.nstd_linkage

_entity_poly.nstd_monomer

_entity_poly.pdbx_seq_one_letter_code

_entity_poly.pdbx_seq_one_letter_code_can

_entity_poly.pdbx_strand_id

1 polydeoxyribonucleotide no no '(DG)(DC)(DG)(DA)(DA)(DA)(DA)(DG)(DT)(DG)(DT)(DG)(DA)(DC)'

GCGAAAAGTGTGAC

C,E

2 polydeoxyribonucleotide no no '(DA)(DT)(DA)(DT)(DG)(DT)(DC)(DA)(DC)(DA)(DC)(DT)(DT)(DT)(DT)(DC)(DG)'

ATATGTCACACTTTTCG

D,F

3 'polypeptide(L)' no no

;VLGKPQTDPTLEWFLSHCHIHKYPSKSTLIHQGEKAETLYYIVKGSVAVLIKDEEGKEMILSYLNQGDFIGELGLFEEGQ

ERSAWVRAKTACEVAEISYKKFRQLIQVNPDILMRLSAQMARRLQVTSEKVGNLAFLDVTGRIAQTLLNLAKQPDAMTHP

DGMQIKITRQEIGQIVGCSRETVGRILKMLEDQNLISAHGKTIVVYGTR

;

;VLGKPQTDPTLEWFLSHCHIHKYPSKSTLIHQGEKAETLYYIVKGSVAVLIKDEEGKEMILSYLNQGDFIGELGLFEEGQ

ERSAWVRAKTACEVAEISYKKFRQLIQVNPDILMRLSAQMARRLQVTSEKVGNLAFLDVTGRIAQTLLNLAKQPDAMTHP

DGMQIKITRQEIGQIVGCSRETVGRILKMLEDQNLISAHGKTIVVYGTR

;

A,B

#

loop_

_entity_poly_seq.entity_id

_entity_poly_seq.num

_entity_poly_seq.mon_id

_entity_poly_seq.hetero

1 1 DG n

1 2 DC n

1 3 DG n

1 4 DA n

1 5 DA n

1 6 DA n

1 7 DA n

1 8 DG n

1 9 DT n

1 10 DG n

1 11 DT n

1 12 DG n

1 13 DA n

1 14 DC n

2 1 DA n

2 2 DT n

2 3 DA n

2 4 DT n

2 5 DG n

2 6 DT n

2 7 DC n

2 8 DA n

2 9 DC n

2 10 DA n

2 11 DC n

2 12 DT n

2 13 DT n

2 14 DT n

2 15 DT n

2 16 DC n

2 17 DG n

3 1 VAL n

3 2 LEU n

3 3 GLY n

3 4 LYS n

3 5 PRO n

3 6 GLN n

3 7 THR n

3 8 ASP n

3 9 PRO n

3 10 THR n

3 11 LEU n

3 12 GLU n

3 13 TRP n

3 14 PHE n

3 15 LEU n

3 16 SER n

3 17 HIS n

3 18 CYS n

3 19 HIS n

3 20 ILE n

3 21 HIS n

3 22 LYS n

3 23 TYR n

3 24 PRO n

3 25 SER n

3 26 LYS n

3 27 SER n

3 28 THR n

3 29 LEU n

3 30 ILE n

3 31 HIS n

3 32 GLN n

3 33 GLY n

3 34 GLU n

3 35 LYS n

3 36 ALA n

3 37 GLU n

3 38 THR n

3 39 LEU n

3 40 TYR n

3 41 TYR n

3 42 ILE n

3 43 VAL n

3 44 LYS n

3 45 GLY n

3 46 SER n

3 47 VAL n

3 48 ALA n

3 49 VAL n

3 50 LEU n

3 51 ILE n

3 52 LYS n

3 53 ASP n

3 54 GLU n

3 55 GLU n

3 56 GLY n

3 57 LYS n

3 58 GLU n

3 59 MET n

3 60 ILE n

3 61 LEU n

3 62 SER n

3 63 TYR n

3 64 LEU n

3 65 ASN n

3 66 GLN n

3 67 GLY n

3 68 ASP n

3 69 PHE n

3 70 ILE n

3 71 GLY n

3 72 GLU n

3 73 LEU n

3 74 GLY n

3 75 LEU n

3 76 PHE n

3 77 GLU n

3 78 GLU n

3 79 GLY n

3 80 GLN n

3 81 GLU n

3 82 ARG n

3 83 SER n

3 84 ALA n

3 85 TRP n

3 86 VAL n

3 87 ARG n

3 88 ALA n

3 89 LYS n

3 90 THR n

3 91 ALA n

3 92 CYS n

3 93 GLU n

3 94 VAL n

3 95 ALA n

3 96 GLU n

3 97 ILE n

3 98 SER n

3 99 TYR n

3 100 LYS n

3 101 LYS n

3 102 PHE n

3 103 ARG n

3 104 GLN n

3 105 LEU n

3 106 ILE n

3 107 GLN n

3 108 VAL n

3 109 ASN n

3 110 PRO n

3 111 ASP n

3 112 ILE n

3 113 LEU n

3 114 MET n

3 115 ARG n

3 116 LEU n

3 117 SER n

3 118 ALA n

3 119 GLN n

3 120 MET n

3 121 ALA n

3 122 ARG n

3 123 ARG n

3 124 LEU n

3 125 GLN n

3 126 VAL n

3 127 THR n

3 128 SER n

3 129 GLU n

3 130 LYS n

3 131 VAL n

3 132 GLY n

3 133 ASN n

3 134 LEU n

3 135 ALA n

3 136 PHE n

3 137 LEU n

3 138 ASP n

3 139 VAL n

3 140 THR n

3 141 GLY n

3 142 ARG n

3 143 ILE n

3 144 ALA n

3 145 GLN n

3 146 THR n

3 147 LEU n

3 148 LEU n

3 149 ASN n

3 150 LEU n

3 151 ALA n

3 152 LYS n

3 153 GLN n

3 154 PRO n

3 155 ASP n

3 156 ALA n

3 157 MET n

3 158 THR n

3 159 HIS n

3 160 PRO n

3 161 ASP n

3 162 GLY n

3 163 MET n

3 164 GLN n

3 165 ILE n

3 166 LYS n

3 167 ILE n

3 168 THR n

3 169 ARG n

3 170 GLN n

3 171 GLU n

3 172 ILE n

3 173 GLY n

3 174 GLN n

3 175 ILE n

3 176 VAL n

3 177 GLY n

3 178 CYS n

3 179 SER n

3 180 ARG n

3 181 GLU n

3 182 THR n

3 183 VAL n

3 184 GLY n

3 185 ARG n

3 186 ILE n

3 187 LEU n

3 188 LYS n

3 189 MET n

3 190 LEU n

3 191 GLU n

3 192 ASP n

3 193 GLN n

3 194 ASN n

3 195 LEU n

3 196 ILE n

3 197 SER n

3 198 ALA n

3 199 HIS n

3 200 GLY n

3 201 LYS n

3 202 THR n

3 203 ILE n

3 204 VAL n

3 205 VAL n

3 206 TYR n

3 207 GLY n

3 208 THR n

3 209 ARG n

#

_entity_src_gen.entity_id 3

_entity_src_gen.gene_src_common_name ?

_entity_src_gen.gene_src_genus Escherichia

_entity_src_gen.pdbx_gene_src_gene ?

_entity_src_gen.gene_src_species ?

_entity_src_gen.gene_src_strain ?

_entity_src_gen.gene_src_tissue ?

_entity_src_gen.gene_src_tissue_fraction ?

_entity_src_gen.gene_src_details ?

_entity_src_gen.pdbx_gene_src_fragment ?

_entity_src_gen.pdbx_gene_src_scientific_name 'Escherichia coli'

_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 562

_entity_src_gen.pdbx_gene_src_variant ?

_entity_src_gen.pdbx_gene_src_cell_line ?

_entity_src_gen.pdbx_gene_src_atcc ?

_entity_src_gen.pdbx_gene_src_organ ?

_entity_src_gen.pdbx_gene_src_organelle ?

_entity_src_gen.pdbx_gene_src_cell ?

_entity_src_gen.pdbx_gene_src_cellular_location ?

_entity_src_gen.host_org_common_name ?

_entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli'

_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 562

_entity_src_gen.host_org_genus Escherichia

_entity_src_gen.pdbx_host_org_gene ?

_entity_src_gen.pdbx_host_org_organ ?

_entity_src_gen.host_org_species ?

_entity_src_gen.pdbx_host_org_tissue ?

_entity_src_gen.pdbx_host_org_tissue_fraction ?

_entity_src_gen.pdbx_host_org_strain ?

_entity_src_gen.pdbx_host_org_variant ?

_entity_src_gen.pdbx_host_org_cell_line ?

_entity_src_gen.pdbx_host_org_atcc ?

_entity_src_gen.pdbx_host_org_culture_collection ?

_entity_src_gen.pdbx_host_org_cell ?

_entity_src_gen.pdbx_host_org_organelle ?

_entity_src_gen.pdbx_host_org_cellular_location ?

_entity_src_gen.pdbx_host_org_vector_type ?

_entity_src_gen.pdbx_host_org_vector ?

_entity_src_gen.plasmid_name ?

_entity_src_gen.plasmid_details ?

_entity_src_gen.pdbx_description ?

#

loop_

_struct_ref.id

_struct_ref.db_name

_struct_ref.db_code

_struct_ref.entity_id

_struct_ref.pdbx_seq_one_letter_code

_struct_ref.pdbx_align_begin

_struct_ref.biol_id

_struct_ref.pdbx_db_accession

1 UNP CRP_ECOLI 3 ? ? . P0ACJ8

2 PDB 1J59 1 ? ? . 1J59

3 PDB 1J59 2 ? ? . 1J59

#

loop_

_struct_ref_seq.align_id

_struct_ref_seq.ref_id

_struct_ref_seq.pdbx_PDB_id_code

_struct_ref_seq.pdbx_strand_id

_struct_ref_seq.seq_align_beg

_struct_ref_seq.pdbx_seq_align_beg_ins_code

_struct_ref_seq.seq_align_end

_struct_ref_seq.pdbx_seq_align_end_ins_code

_struct_ref_seq.pdbx_db_accession

_struct_ref_seq.db_align_beg

_struct_ref_seq.pdbx_db_align_beg_ins_code

_struct_ref_seq.db_align_end

_struct_ref_seq.pdbx_db_align_end_ins_code

_struct_ref_seq.pdbx_auth_seq_align_beg

_struct_ref_seq.pdbx_auth_seq_align_end

1 1 1J59 A 1 ? 209 ? P0ACJ8 2 ? 210 ? 1 209

2 1 1J59 B 1 ? 209 ? P0ACJ8 2 ? 210 ? 1 209

3 2 1J59 C 1 ? 14 ? 1J59 -5 ? 9 ? -5 9

4 3 1J59 D 1 ? 17 ? 1J59 10 ? 26 ? 10 26

5 2 1J59 E 1 ? 14 ? 1J59 27 ? 14 ? 27 14

6 3 1J59 F 1 ? 17 ? 1J59 13 ? -4 ? 13 -4

#

loop_

_chem_comp.id

_chem_comp.type

_chem_comp.mon_nstd_flag

_chem_comp.name

_chem_comp.pdbx_synonyms

_chem_comp.formula

_chem_comp.formula_weight

DG 'DNA linking' y "2'-DEOXYGUANOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O7 P' 347.224

DC 'DNA linking' y "2'-DEOXYCYTIDINE-5'-MONOPHOSPHATE" ? 'C9 H14 N3 O7 P' 307.199

DA 'DNA linking' y "2'-DEOXYADENOSINE-5'-MONOPHOSPHATE" ? 'C10 H14 N5 O6 P' 331.224

DT 'DNA linking' y "THYMIDINE-5'-MONOPHOSPHATE" ? 'C10 H15 N2 O8 P' 322.211

PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.132

THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.120

LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.174

GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.130

TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.228

PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.191

SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093

HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.164

CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.154

ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.174

LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.197

TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.191

GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.146

GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067

ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.094

VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.147

ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.104

MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.207

ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.119

ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.210

CMP non-polymer . "ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE" 'CYCLIC AMP; CAMP' 'C10 H12 N5 O6 P' 329.208

HOH non-polymer . WATER ? 'H2 O' 18.015

#

_exptl.entry_id 1J59

_exptl.method 'X-RAY DIFFRACTION'

_exptl.crystals_number ?

#

_exptl_crystal.id 1

_exptl_crystal.density_meas ?

_exptl_crystal.density_Matthews 3.50

_exptl_crystal.density_percent_sol 58.71

_exptl_crystal.description ?

#

_exptl_crystal_grow.crystal_id 1

_exptl_crystal_grow.method ?

_exptl_crystal_grow.temp ?

_exptl_crystal_grow.temp_details ?

_exptl_crystal_grow.pH 6.50

_exptl_crystal_grow.pdbx_details 'pH 6.50'

_exptl_crystal_grow.pdbx_pH_range .

#

_diffrn.id 1

_diffrn.ambient_temp ?

_diffrn.ambient_temp_details ?

_diffrn.crystal_id 1

#

_diffrn_detector.diffrn_id 1

_diffrn_detector.detector 'IMAGE PLATE'

_diffrn_detector.type FUJI

_diffrn_detector.pdbx_collection_date 1992-11-01

_diffrn_detector.details ?

#

_diffrn_radiation.diffrn_id 1

_diffrn_radiation.wavelength_id 1

_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M

_diffrn_radiation.monochromator ?

_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH'

#

_diffrn_radiation_wavelength.id 1

_diffrn_radiation_wavelength.wavelength 0.9100

_diffrn_radiation_wavelength.wt 1.0

#

_diffrn_source.diffrn_id 1

_diffrn_source.source SYNCHROTRON

_diffrn_source.type 'CHESS BEAMLINE F1'

_diffrn_source.pdbx_synchrotron_site CHESS

_diffrn_source.pdbx_synchrotron_beamline F1

_diffrn_source.pdbx_wavelength 0.9100

_diffrn_source.pdbx_wavelength_list ?

#

_reflns.entry_id 1J59

_reflns.observed_criterion_sigma_I ?

_reflns.observed_criterion_sigma_F ?

_reflns.d_resolution_low 30.000

_reflns.d_resolution_high 2.500

_reflns.number_obs 23876

_reflns.number_all ?

_reflns.percent_possible_obs 85.4

_reflns.pdbx_Rmerge_I_obs 0.1147

_reflns.pdbx_Rsym_value ?

_reflns.pdbx_netI_over_sigmaI 2.0000

_reflns.B_iso_Wilson_estimate ?

_reflns.pdbx_redundancy ?

_reflns.R_free_details ?

_reflns.limit_h_max ?

_reflns.limit_h_min ?

_reflns.limit_k_max ?

_reflns.limit_k_min ?

_reflns.limit_l_max ?

_reflns.limit_l_min ?

_reflns.observed_criterion_F_max ?

_reflns.observed_criterion_F_min ?

#

_computing.entry_id 1J59

_computing.pdbx_data_reduction_ii 'PURDUE DATA PROCESSING PACKAGE'

_computing.pdbx_data_reduction_ds ?

_computing.data_collection ?

_computing.structure_solution ?

_computing.structure_refinement X-PLOR

_computing.pdbx_structure_refinement_method ?

#

_refine.entry_id 1J59

_refine.ls_number_reflns_obs 23644

_refine.ls_number_reflns_all ?

_refine.pdbx_ls_sigma_I ?

_refine.pdbx_ls_sigma_F 2.000

_refine.pdbx_data_cutoff_high_absF ?

_refine.pdbx_data_cutoff_low_absF ?

_refine.pdbx_data_cutoff_high_rms_absF ?

_refine.ls_d_res_low 10.00

_refine.ls_d_res_high 2.50

_refine.ls_percent_reflns_obs 86.0

_refine.ls_R_factor_obs 0.199

_refine.ls_R_factor_all ?

_refine.ls_R_factor_R_work 0.199

_refine.ls_R_factor_R_free 0.279

_refine.ls_R_factor_R_free_error ?

_refine.ls_R_factor_R_free_error_details ?

_refine.ls_percent_reflns_R_free ?

_refine.ls_number_reflns_R_free ?

_refine.ls_number_parameters ?

_refine.ls_number_restraints ?

_refine.occupancy_min ?

_refine.occupancy_max ?

_refine.correlation_coeff_Fo_to_Fc ?

_refine.correlation_coeff_Fo_to_Fc_free ?

_refine.B_iso_mean 30.90

_refine.aniso_B[1][1] ?

_refine.aniso_B[2][2] ?

_refine.aniso_B[3][3] ?

_refine.aniso_B[1][2] ?

_refine.aniso_B[1][3] ?

_refine.aniso_B[2][3] ?

_refine.solvent_model_details ?

_refine.solvent_model_param_ksol ?

_refine.solvent_model_param_bsol ?

_refine.pdbx_solvent_vdw_probe_radii ?

_refine.pdbx_solvent_ion_probe_radii ?

_refine.pdbx_solvent_shrinkage_radii ?

_refine.pdbx_ls_cross_valid_method ?

_refine.details ?

_refine.pdbx_starting_model ?

_refine.pdbx_method_to_determine_struct ?

_refine.pdbx_isotropic_thermal_model ?

_refine.pdbx_stereochemistry_target_values ?

_refine.pdbx_stereochem_target_val_spec_case ?

_refine.pdbx_R_Free_selection_details ?

_refine.pdbx_overall_ESU_R ?

_refine.pdbx_overall_ESU_R_Free ?

_refine.overall_SU_ML ?

_refine.overall_SU_B ?

_refine.ls_redundancy_reflns_obs ?

_refine.overall_SU_R_Cruickshank_DPI ?

_refine.overall_SU_R_free ?

_refine.B_iso_min ?

_refine.B_iso_max ?

_refine.pdbx_refine_id 'X-RAY DIFFRACTION'

#

_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION'

_refine_hist.cycle_id LAST

_refine_hist.pdbx_number_atoms_protein 3128

_refine_hist.pdbx_number_atoms_nucleic_acid 1262

_refine_hist.pdbx_number_atoms_ligand 42

_refine_hist.number_atoms_solvent 286

_refine_hist.number_atoms_total 4718

_refine_hist.d_res_high 2.50

_refine_hist.d_res_low 10.00

#

loop_

_refine_ls_restr.type

_refine_ls_restr.dev_ideal

_refine_ls_restr.dev_ideal_target

_refine_ls_restr.weight

_refine_ls_restr.number

_refine_ls_restr.pdbx_refine_id

x_bond_d 0.017 ? ? ? 'X-RAY DIFFRACTION'

x_bond_d_na ? ? ? ? 'X-RAY DIFFRACTION'

x_bond_d_prot ? ? ? ? 'X-RAY DIFFRACTION'

x_angle_d ? ? ? ? 'X-RAY DIFFRACTION'

x_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION'

x_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION'

x_angle_deg 2.27 ? ? ? 'X-RAY DIFFRACTION'

x_angle_deg_na ? ? ? ? 'X-RAY DIFFRACTION'

x_angle_deg_prot ? ? ? ? 'X-RAY DIFFRACTION'

x_dihedral_angle_d 22.90 ? ? ? 'X-RAY DIFFRACTION'

x_dihedral_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION'

x_dihedral_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION'

x_improper_angle_d 1.40 ? ? ? 'X-RAY DIFFRACTION'

x_improper_angle_d_na ? ? ? ? 'X-RAY DIFFRACTION'

x_improper_angle_d_prot ? ? ? ? 'X-RAY DIFFRACTION'

x_mcbond_it ? ? ? ? 'X-RAY DIFFRACTION'

x_mcangle_it ? ? ? ? 'X-RAY DIFFRACTION'

x_scbond_it ? ? ? ? 'X-RAY DIFFRACTION'

x_scangle_it ? ? ? ? 'X-RAY DIFFRACTION'

#

_struct.entry_id 1J59

_struct.title

;CATABOLITE GENE ACTIVATOR PROTEIN (CAP)/DNA COMPLEX + ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE

;

_struct.pdbx_descriptor

;CATABOLITE GENE ACTIVATOR PROTEIN (CAP)/DNA Complex, ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE

;

_struct.pdbx_model_details ?

_struct.pdbx_model_type_details ?

#

_struct_keywords.entry_id 1J59

_struct_keywords.pdbx_keywords 'GENE REGULATION/DNA'

_struct_keywords.text 'PROTEIN-DNA COMPLEX, GENE-REGULATORY, GENE REGULATION/DNA COMPLEX'

#

loop_

_struct_asym.id

_struct_asym.pdbx_blank_PDB_chainid_flag

_struct_asym.pdbx_modified

_struct_asym.entity_id

_struct_asym.details

A N N 1 ?

B N N 2 ?

C N N 1 ?

D N N 2 ?

E N N 3 ?

F N N 3 ?

G N N 4 ?

H N N 4 ?

I N N 5 ?

J N N 5 ?

K N N 5 ?

L N N 5 ?

M N N 5 ?

N N N 5 ?

#

_struct_biol.id 1

_struct_biol.pdbx_parent_biol_id ?

_struct_biol.details ?

#

loop_

_struct_conf.conf_type_id

_struct_conf.id

_struct_conf.pdbx_PDB_helix_id

_struct_conf.beg_label_comp_id

_struct_conf.beg_label_asym_id

_struct_conf.beg_label_seq_id

_struct_conf.pdbx_beg_PDB_ins_code

_struct_conf.end_label_comp_id

_struct_conf.end_label_asym_id

_struct_conf.end_label_seq_id

_struct_conf.pdbx_end_PDB_ins_code

_struct_conf.beg_auth_comp_id

_struct_conf.beg_auth_asym_id

_struct_conf.beg_auth_seq_id

_struct_conf.end_auth_comp_id

_struct_conf.end_auth_asym_id

_struct_conf.end_auth_seq_id

_struct_conf.pdbx_PDB_helix_class

_struct_conf.details

_struct_conf.pdbx_PDB_helix_length

HELX_P HELX_P1 1 THR E 10 ? HIS E 17 ? THR A 10 HIS A 17 1 ? 8

HELX_P HELX_P2 2 TYR E 99 ? ILE E 106 ? TYR A 99 ILE A 106 1 ? 8

HELX_P HELX_P3 3 PRO E 110 ? PHE E 136 ? PRO A 110 PHE A 136 5 ? 27

HELX_P HELX_P4 4 VAL E 139 ? LYS E 152 ? VAL A 139 LYS A 152 1 ? 14

HELX_P HELX_P5 5 ARG E 169 ? VAL E 176 ? ARG A 169 VAL A 176 1 ? 8

HELX_P HELX_P6 6 ARG E 180 ? ASP E 192 ? ARG A 180 ASP A 192 1 ? 13

HELX_P HELX_P7 7 THR F 10 ? SER F 16 ? THR B 10 SER B 16 1 ? 7

HELX_P HELX_P8 8 GLY F 74 ? PHE F 76 ? GLY B 74 PHE B 76 5 ? 3

HELX_P HELX_P9 9 TYR F 99 ? VAL F 108 ? TYR B 99 VAL B 108 1 ? 10

HELX_P HELX_P10 10 PRO F 110 ? PHE F 136 ? PRO B 110 PHE B 136 1 ? 27

HELX_P HELX_P11 11 VAL F 139 ? LEU F 150 ? VAL B 139 LEU B 150 1 ? 12

HELX_P HELX_P12 12 ARG F 169 ? VAL F 176 ? ARG B 169 VAL B 176 1 ? 8

HELX_P HELX_P13 13 ARG F 180 ? GLU F 191 ? ARG B 180 GLU B 191 1 ? 12

#

_struct_conf_type.id HELX_P

_struct_conf_type.criteria ?

_struct_conf_type.reference ?

#

loop_

_struct_conn.id

_struct_conn.conn_type_id

_struct_conn.pdbx_PDB_id

_struct_conn.ptnr1_label_asym_id

_struct_conn.ptnr1_label_comp_id

_struct_conn.ptnr1_label_seq_id

_struct_conn.ptnr1_label_atom_id

_struct_conn.pdbx_ptnr1_label_alt_id

_struct_conn.pdbx_ptnr1_PDB_ins_code

_struct_conn.pdbx_ptnr1_standard_comp_id

_struct_conn.ptnr1_symmetry

_struct_conn.ptnr2_label_asym_id

_struct_conn.ptnr2_label_comp_id

_struct_conn.ptnr2_label_seq_id

_struct_conn.ptnr2_label_atom_id

_struct_conn.pdbx_ptnr2_label_alt_id

_struct_conn.pdbx_ptnr2_PDB_ins_code

_struct_conn.ptnr1_auth_asym_id

_struct_conn.ptnr1_auth_comp_id

_struct_conn.ptnr1_auth_seq_id

_struct_conn.ptnr2_auth_asym_id

_struct_conn.ptnr2_auth_comp_id

_struct_conn.ptnr2_auth_seq_id

_struct_conn.ptnr2_symmetry

_struct_conn.pdbx_ptnr3_label_atom_id

_struct_conn.pdbx_ptnr3_label_seq_id

_struct_conn.pdbx_ptnr3_label_comp_id

_struct_conn.pdbx_ptnr3_label_asym_id

_struct_conn.pdbx_ptnr3_label_alt_id

_struct_conn.pdbx_ptnr3_PDB_ins_code

_struct_conn.details

_struct_conn.pdbx_dist_value

mismat1 mismat ? B DA 3 . ? ? ? 1_555 D DA 1 . ? ? D DA 12 F DA 13 1_555 ? ? ? ? ? ? ? ?

mismat2 mismat ? B DC 9 . ? ? ? 1_555 C DT 9 . ? ? D DC 18 E DT 19 1_555 ? ? ? ? ? ? ? ?

mismat3 mismat ? B DC 11 . ? ? ? 1_555 C DA 7 . ? ? D DC 20 E DA 21 1_555 ? ? ? ? ? ? ? ?

hydrog1 hydrog ? A DC 2 N3 ? ? ? 1_555 D DG 17 N1 ? ? C DC -4 F DG -4 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog2 hydrog ? A DC 2 N4 ? ? ? 1_555 D DG 17 O6 ? ? C DC -4 F DG -4 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog3 hydrog ? A DC 2 O2 ? ? ? 1_555 D DG 17 N2 ? ? C DC -4 F DG -4 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog4 hydrog ? A DG 3 N1 ? ? ? 1_555 D DC 16 N3 ? ? C DG -3 F DC -3 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog5 hydrog ? A DG 3 N2 ? ? ? 1_555 D DC 16 O2 ? ? C DG -3 F DC -3 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog6 hydrog ? A DG 3 O6 ? ? ? 1_555 D DC 16 N4 ? ? C DG -3 F DC -3 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog7 hydrog ? A DA 4 N1 ? ? ? 1_555 D DT 15 N3 ? ? C DA -2 F DT -2 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog8 hydrog ? A DA 4 N6 ? ? ? 1_555 D DT 15 O4 ? ? C DA -2 F DT -2 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog9 hydrog ? A DA 5 N1 ? ? ? 1_555 D DT 14 N3 ? ? C DA -1 F DT -1 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog10 hydrog ? A DA 5 N6 ? ? ? 1_555 D DT 14 O4 ? ? C DA -1 F DT -1 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog11 hydrog ? A DA 6 N1 ? ? ? 1_555 D DT 13 N3 ? ? C DA 1 F DT 1 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog12 hydrog ? A DA 6 N6 ? ? ? 1_555 D DT 13 O4 ? ? C DA 1 F DT 1 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog13 hydrog ? A DA 7 N1 ? ? ? 1_555 D DT 12 N3 ? ? C DA 2 F DT 2 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog14 hydrog ? A DA 7 N6 ? ? ? 1_555 D DT 12 O4 ? ? C DA 2 F DT 2 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog15 hydrog ? A DG 8 N1 ? ? ? 1_555 D DC 11 N3 ? ? C DG 3 F DC 3 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog16 hydrog ? A DG 8 N2 ? ? ? 1_555 D DC 11 O2 ? ? C DG 3 F DC 3 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog17 hydrog ? A DG 8 O6 ? ? ? 1_555 D DC 11 N4 ? ? C DG 3 F DC 3 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog18 hydrog ? A DT 9 N3 ? ? ? 1_555 D DA 10 N1 ? ? C DT 4 F DA 4 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog19 hydrog ? A DT 9 O4 ? ? ? 1_555 D DA 10 N6 ? ? C DT 4 F DA 4 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog20 hydrog ? A DG 10 N1 ? ? ? 1_555 D DC 9 N3 ? ? C DG 5 F DC 5 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog21 hydrog ? A DG 10 N2 ? ? ? 1_555 D DC 9 O2 ? ? C DG 5 F DC 5 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog22 hydrog ? A DG 10 O6 ? ? ? 1_555 D DC 9 N4 ? ? C DG 5 F DC 5 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog23 hydrog ? A DT 11 N3 ? ? ? 1_555 D DA 8 N1 ? ? C DT 6 F DA 6 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog24 hydrog ? A DT 11 O4 ? ? ? 1_555 D DA 8 N6 ? ? C DT 6 F DA 6 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog25 hydrog ? A DG 12 N1 ? ? ? 1_555 D DC 7 N3 ? ? C DG 7 F DC 7 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog26 hydrog ? A DG 12 N2 ? ? ? 1_555 D DC 7 O2 ? ? C DG 7 F DC 7 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog27 hydrog ? A DG 12 O6 ? ? ? 1_555 D DC 7 N4 ? ? C DG 7 F DC 7 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog28 hydrog ? A DA 13 N1 ? ? ? 1_555 D DT 6 N3 ? ? C DA 8 F DT 8 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog29 hydrog ? A DA 13 N6 ? ? ? 1_555 D DT 6 O4 ? ? C DA 8 F DT 8 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog30 hydrog ? A DC 14 N3 ? ? ? 1_555 D DG 5 N1 ? ? C DC 9 F DG 9 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog31 hydrog ? A DC 14 N4 ? ? ? 1_555 D DG 5 O6 ? ? C DC 9 F DG 9 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog32 hydrog ? A DC 14 O2 ? ? ? 1_555 D DG 5 N2 ? ? C DC 9 F DG 9 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog33 hydrog ? B DA 1 N1 ? ? ? 1_555 D DT 4 N3 ? ? D DA 10 F DT 10 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog34 hydrog ? B DA 1 N6 ? ? ? 1_555 D DT 4 O4 ? ? D DA 10 F DT 10 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog35 hydrog ? B DT 2 N3 ? ? ? 1_555 D DA 3 N1 ? ? D DT 11 F DA 11 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog36 hydrog ? B DT 2 O4 ? ? ? 1_555 D DA 3 N6 ? ? D DT 11 F DA 11 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog37 hydrog ? B DA 3 N6 ? ? ? 1_555 D DA 1 N1 ? ? D DA 12 F DA 13 1_555 ? ? ? ? ? ? 'DA-DA MISPAIR' ?

hydrog38 hydrog ? B DA 3 N1 ? ? ? 1_555 D DT 2 N3 ? ? D DA 12 F DT 12 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog39 hydrog ? B DA 3 N6 ? ? ? 1_555 D DT 2 O4 ? ? D DA 12 F DT 12 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog40 hydrog ? B DT 4 N3 ? ? ? 1_555 D DA 1 N1 ? ? D DT 13 F DA 13 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog41 hydrog ? B DT 4 O4 ? ? ? 1_555 D DA 1 N6 ? ? D DT 13 F DA 13 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog42 hydrog ? B DG 5 N1 ? ? ? 1_555 C DC 14 N3 ? ? D DG 14 E DC 14 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog43 hydrog ? B DG 5 N2 ? ? ? 1_555 C DC 14 O2 ? ? D DG 14 E DC 14 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog44 hydrog ? B DG 5 O6 ? ? ? 1_555 C DC 14 N4 ? ? D DG 14 E DC 14 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog45 hydrog ? B DT 6 N3 ? ? ? 1_555 C DA 13 N1 ? ? D DT 15 E DA 15 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog46 hydrog ? B DT 6 O4 ? ? ? 1_555 C DA 13 N6 ? ? D DT 15 E DA 15 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog47 hydrog ? B DC 7 N3 ? ? ? 1_555 C DG 12 N1 ? ? D DC 16 E DG 16 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog48 hydrog ? B DC 7 N4 ? ? ? 1_555 C DG 12 O6 ? ? D DC 16 E DG 16 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog49 hydrog ? B DC 7 O2 ? ? ? 1_555 C DG 12 N2 ? ? D DC 16 E DG 16 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog50 hydrog ? B DA 8 N1 ? ? ? 1_555 C DT 11 N3 ? ? D DA 17 E DT 17 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog51 hydrog ? B DA 8 N6 ? ? ? 1_555 C DT 11 O4 ? ? D DA 17 E DT 17 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog52 hydrog ? B DC 9 N4 ? ? ? 1_555 C DT 9 O4 ? ? D DC 18 E DT 19 1_555 ? ? ? ? ? ? 'DC-DT MISPAIR' ?

hydrog53 hydrog ? B DC 9 N3 ? ? ? 1_555 C DG 10 N1 ? ? D DC 18 E DG 18 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog54 hydrog ? B DC 9 N4 ? ? ? 1_555 C DG 10 O6 ? ? D DC 18 E DG 18 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog55 hydrog ? B DC 9 O2 ? ? ? 1_555 C DG 10 N2 ? ? D DC 18 E DG 18 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog56 hydrog ? B DA 10 N1 ? ? ? 1_555 C DT 9 N3 ? ? D DA 19 E DT 19 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog57 hydrog ? B DA 10 N6 ? ? ? 1_555 C DT 9 O4 ? ? D DA 19 E DT 19 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog58 hydrog ? B DC 11 N3 ? ? ? 1_555 C DA 7 N6 ? ? D DC 20 E DA 21 1_555 ? ? ? ? ? ? 'DC-DA MISPAIR' ?

hydrog59 hydrog ? B DC 11 N3 ? ? ? 1_555 C DG 8 N1 ? ? D DC 20 E DG 20 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog60 hydrog ? B DC 11 N4 ? ? ? 1_555 C DG 8 O6 ? ? D DC 20 E DG 20 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog61 hydrog ? B DC 11 O2 ? ? ? 1_555 C DG 8 N2 ? ? D DC 20 E DG 20 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog62 hydrog ? B DT 12 O4 ? ? ? 1_555 C DA 6 N6 ? ? D DT 21 E DA 22 1_555 ? ? ? ? ? ? 'DT-DA PAIR' ?

hydrog63 hydrog ? B DT 12 N3 ? ? ? 1_555 C DA 7 N1 ? ? D DT 21 E DA 21 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog64 hydrog ? B DT 12 O4 ? ? ? 1_555 C DA 7 N6 ? ? D DT 21 E DA 21 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog65 hydrog ? B DT 13 O4 ? ? ? 1_555 C DA 5 N6 ? ? D DT 22 E DA 23 1_555 ? ? ? ? ? ? 'DT-DA PAIR' ?

hydrog66 hydrog ? B DT 13 N3 ? ? ? 1_555 C DA 6 N1 ? ? D DT 22 E DA 22 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog67 hydrog ? B DT 13 O4 ? ? ? 1_555 C DA 6 N6 ? ? D DT 22 E DA 22 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog68 hydrog ? B DT 14 N3 ? ? ? 1_555 C DA 5 N1 ? ? D DT 23 E DA 23 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog69 hydrog ? B DT 14 O4 ? ? ? 1_555 C DA 5 N6 ? ? D DT 23 E DA 23 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog70 hydrog ? B DT 15 N3 ? ? ? 1_555 C DA 4 N1 ? ? D DT 24 E DA 24 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog71 hydrog ? B DT 15 O4 ? ? ? 1_555 C DA 4 N6 ? ? D DT 24 E DA 24 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog72 hydrog ? B DC 16 N3 ? ? ? 1_555 C DG 3 N1 ? ? D DC 25 E DG 25 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog73 hydrog ? B DC 16 N4 ? ? ? 1_555 C DG 3 O6 ? ? D DC 25 E DG 25 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog74 hydrog ? B DC 16 O2 ? ? ? 1_555 C DG 3 N2 ? ? D DC 25 E DG 25 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog75 hydrog ? B DG 17 N1 ? ? ? 1_555 C DC 2 N3 ? ? D DG 26 E DC 26 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog76 hydrog ? B DG 17 N2 ? ? ? 1_555 C DC 2 O2 ? ? D DG 26 E DC 26 1_555 ? ? ? ? ? ? WATSON-CRICK ?

hydrog77 hydrog ? B DG 17 O6 ? ? ? 1_555 C DC 2 N4 ? ? D DG 26 E DC 26 1_555 ? ? ? ? ? ? WATSON-CRICK ?

#

loop_

_struct_conn_type.id

_struct_conn_type.criteria

_struct_conn_type.reference

hydrog 'For hydrogen bonding between nucleic acid bases, donor to acceptor distance of 2.2 -3.5 Angstroms was used.' ?

mismat ? ?

#

loop_

_struct_sheet.id

_struct_sheet.type

_struct_sheet.number_strands

_struct_sheet.details

A ? 3 ?

B ? 3 ?

C ? 3 ?

D ? 3 ?

E ? 2 ?

F ? 2 ?

#

loop_

_struct_sheet_order.sheet_id

_struct_sheet_order.range_id_1

_struct_sheet_order.range_id_2

_struct_sheet_order.offset

_struct_sheet_order.sense

A 1 2 ? anti-parallel

A 2 3 ? anti-parallel

B 1 2 ? anti-parallel

B 2 3 ? anti-parallel

C 1 2 ? anti-parallel

C 2 3 ? anti-parallel

D 1 2 ? anti-parallel

D 2 3 ? anti-parallel

E 1 2 ? anti-parallel

F 1 2 ? anti-parallel

#

loop_

_struct_sheet_range.sheet_id

_struct_sheet_range.id

_struct_sheet_range.beg_label_comp_id

_struct_sheet_range.beg_label_asym_id

_struct_sheet_range.beg_label_seq_id

_struct_sheet_range.pdbx_beg_PDB_ins_code

_struct_sheet_range.end_label_comp_id

_struct_sheet_range.end_label_asym_id

_struct_sheet_range.end_label_seq_id

_struct_sheet_range.pdbx_end_PDB_ins_code

_struct_sheet_range.symmetry

_struct_sheet_range.beg_auth_comp_id

_struct_sheet_range.beg_auth_asym_id

_struct_sheet_range.beg_auth_seq_id

_struct_sheet_range.end_auth_comp_id

_struct_sheet_range.end_auth_asym_id

_struct_sheet_range.end_auth_seq_id

A 1 TRP E 85 . ALA E 88 . ? TRP A 85 ALA A 88

A 2 VAL E 47 . LYS E 52 . ? VAL A 47 LYS A 52

A 3 GLU E 58 . LEU E 64 . ? GLU A 58 LEU A 64

B 1 MET E 163 . LYS E 166 . ? MET A 163 LYS A 166

B 2 LYS E 201 . VAL E 204 . ? LYS A 201 VAL A 204

B 3 ILE E 196 . ALA E 198 . ? ILE A 196 ALA A 198

C 1 HIS F 19 . TYR F 23 . ? HIS B 19 TYR B 23

C 2 CYS F 92 . SER F 98 . ? CYS B 92 SER B 98

C 3 THR F 38 . LYS F 44 . ? THR B 38 LYS B 44

D 1 TRP F 85 . ALA F 88 . ? TRP B 85 ALA B 88

D 2 SER F 46 . LYS F 52 . ? SER B 46 LYS B 52

D 3 GLU F 58 . ASN F 65 . ? GLU B 58 ASN B 65

E 1 ILE F 196 . HIS F 199 . ? ILE B 196 HIS B 199

E 2 LYS F 201 . VAL F 204 . ? LYS B 201 VAL B 204

F 1 THR E 38 . LYS E 44 . ? THR A 38 LYS A 44

F 2 GLU E 93 . SER E 98 . ? GLU A 93 SER A 98

#

loop_

_pdbx_struct_sheet_hbond.sheet_id

_pdbx_struct_sheet_hbond.range_id_1

_pdbx_struct_sheet_hbond.range_id_2

_pdbx_struct_sheet_hbond.range_1_label_atom_id

_pdbx_struct_sheet_hbond.range_1_label_comp_id

_pdbx_struct_sheet_hbond.range_1_label_asym_id

_pdbx_struct_sheet_hbond.range_1_label_seq_id

_pdbx_struct_sheet_hbond.range_1_PDB_ins_code

_pdbx_struct_sheet_hbond.range_1_auth_atom_id

_pdbx_struct_sheet_hbond.range_1_auth_comp_id

_pdbx_struct_sheet_hbond.range_1_auth_asym_id

_pdbx_struct_sheet_hbond.range_1_auth_seq_id

_pdbx_struct_sheet_hbond.range_2_label_atom_id

_pdbx_struct_sheet_hbond.range_2_label_comp_id

_pdbx_struct_sheet_hbond.range_2_label_asym_id

_pdbx_struct_sheet_hbond.range_2_label_seq_id

_pdbx_struct_sheet_hbond.range_2_PDB_ins_code

_pdbx_struct_sheet_hbond.range_2_auth_atom_id

_pdbx_struct_sheet_hbond.range_2_auth_comp_id

_pdbx_struct_sheet_hbond.range_2_auth_asym_id

_pdbx_struct_sheet_hbond.range_2_auth_seq_id

A 1 2 O TRP E 85 ? O TRP A 85 N LEU E 50 ? N LEU A 50

A 2 3 O VAL E 47 ? O VAL A 47 N LEU E 64 ? N LEU A 64

B 1 2 O MET E 163 ? O MET A 163 N VAL E 204 ? N VAL A 204

B 2 3 O ILE E 203 ? O ILE A 203 N SER E 197 ? N SER A 197

C 1 2 O HIS F 19 ? O HIS B 19 N GLU F 96 ? N GLU B 96

C 2 3 O GLU F 93 ? O GLU B 93 N LYS F 44 ? N LYS B 44

D 1 2 O TRP F 85 ? O TRP B 85 N LEU F 50 ? N LEU B 50

D 2 3 O VAL F 47 ? O VAL B 47 N LEU F 64 ? N LEU B 64

E 1 2 O SER F 197 ? O SER B 197 N ILE F 203 ? N ILE B 203

F 1 2 O LEU E 39 ? O LEU A 39 N ILE E 97 ? N ILE A 97

#

loop_

_struct_site.id

_struct_site.details

_struct_site.pdbx_evidence_code

AC1 'BINDING SITE FOR RESIDUE CMP B 761' SOFTWARE

AC2 'BINDING SITE FOR RESIDUE CMP A 762' SOFTWARE

#

loop_

_struct_site_gen.id

_struct_site_gen.site_id

_struct_site_gen.pdbx_num_res

_struct_site_gen.label_comp_id

_struct_site_gen.label_asym_id

_struct_site_gen.label_seq_id

_struct_site_gen.pdbx_auth_ins_code

_struct_site_gen.auth_comp_id

_struct_site_gen.auth_asym_id

_struct_site_gen.auth_seq_id

_struct_site_gen.label_atom_id

_struct_site_gen.label_alt_id

_struct_site_gen.symmetry

_struct_site_gen.details

1 AC1 10 LEU E 124 ? LEU A 124 . . 1_555 ?

2 AC1 10 SER E 128 ? SER A 128 . . 1_555 ?

3 AC1 10 VAL F 49 ? VAL B 49 . . 1_555 ?

4 AC1 10 GLY F 71 ? GLY B 71 . . 1_555 ?

5 AC1 10 GLU F 72 ? GLU B 72 . . 1_555 ?

6 AC1 10 LEU F 73 ? LEU B 73 . . 1_555 ?

7 AC1 10 ARG F 82 ? ARG B 82 . . 1_555 ?

8 AC1 10 SER F 83 ? SER B 83 . . 1_555 ?

9 AC1 10 ALA F 84 ? ALA B 84 . . 1_555 ?

10 AC1 10 THR F 127 ? THR B 127 . . 1_555 ?

11 AC2 11 ILE E 30 ? ILE A 30 . . 1_555 ?

12 AC2 11 VAL E 49 ? VAL A 49 . . 1_555 ?