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5S9O

CRYSTAL STRUCTURE OF THE HUMAN BRD2 BD1 BROMODOMAIN IN COMPLEX WITH 9-(cyclopropylmethyl)-7-[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazole-1-carboxamide

Functional Information from PDB Data
site_idAC1
Number of Residues12
Detailsbinding site for residue YW1 A 301
ChainResidue
ATRP97
AHOH405
BVAL106
BLYS107
APRO98
APHE99
AGLN101
APRO102
AVAL103
AASP104
AASN156
AEDO302

site_idAC2
Number of Residues5
Detailsbinding site for residue EDO A 302
ChainResidue
AASP160
AASP161
AILE162
AYW1301
AEDO303

site_idAC3
Number of Residues6
Detailsbinding site for residue EDO A 303
ChainResidue
ATHR159
AASP160
AASP161
AEDO302
BPRO111
BHOH405

site_idAC4
Number of Residues6
Detailsbinding site for residue EDO A 304
ChainResidue
AARG74
AGLU184
AHOH421
BLEU108
BGLY109
BEDO303

site_idAC5
Number of Residues4
Detailsbinding site for residue EDO A 305
ChainResidue
ATYR155
AASN156
ALYS157
AASP160

site_idAC6
Number of Residues5
Detailsbinding site for residue EDO A 306
ChainResidue
ASER139
AMET142
AGLN143
BLYS171
BGLN175

site_idAC7
Number of Residues5
Detailsbinding site for residue EDO A 307
ChainResidue
AILE116
AILE117
ALYS118
AGLN119
AASN151

site_idAC8
Number of Residues17
Detailsbinding site for residue YW1 B 301
ChainResidue
AHIS71
AMET72
AGLN94
ATRP136
AGLU140
BPRO98
BPHE99
BGLN101
BPRO102
BVAL103
BASP104
BLYS107
BLEU108
BLEU110
BASN156
BHOH404
BHOH429

site_idAC9
Number of Residues6
Detailsbinding site for residue EDO B 302
ChainResidue
BILE116
BILE117
BLYS118
BGLN119
BASN151
BHOH402

site_idAD1
Number of Residues4
Detailsbinding site for residue EDO B 303
ChainResidue
AGLU186
AEDO304
BTYR155
BLYS157

site_idAD2
Number of Residues3
Detailsbinding site for residue EDO B 304
ChainResidue
ALYS107
BLYS176
BHOH419

Functional Information from PROSITE/UniProt
site_idPS00633
Number of Residues60
DetailsBROMODOMAIN_1 Bromodomain signature. AwpFrqpvDavklglpDYHkiIkqpMdmgtIkrrlenny..Ywaasecmqdfnt.MftNCyiY
ChainResidueDetails
AALA96-TYR155

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues8
DetailsBINDING: BINDING => ECO:0000269|PubMed:37731000, ECO:0007744|PDB:8SB6
ChainResidueDetails
AASP112
ATYR155
AASN156
ALYS157
BASP112
BTYR155
BASN156
BLYS157

site_idSWS_FT_FI2
Number of Residues4
DetailsBINDING: BINDING => ECO:0000269|PubMed:20048151, ECO:0007744|PDB:2DVQ, ECO:0007744|PDB:2DVS
ChainResidueDetails
AASP160
AASP161
BASP160
BASP161

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PDB entries from 2024-10-09

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