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5S9Q

CRYSTAL STRUCTURE OF THE FIRST BROMODOMAIN OF HUMAN BRD4 IN COMPLEX WITH 2-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(2-hydroxypropan-2-yl)-9-[(S)-(oxan-4-yl)(phenyl)methyl]-9H-carbazole-4-carboxamide

Functional Information from PDB Data
site_idAC1
Number of Residues13
Detailsbinding site for residue YW7 A 301
ChainResidue
ATRP81
AILE146
AMET149
AHOH410
AHOH423
APRO82
APHE83
AGLN85
APRO86
AASP88
ALYS91
ALEU92
AASN140

site_idAC2
Number of Residues5
Detailsbinding site for residue EDO A 302
ChainResidue
AMET43
AASN44
AVAL90
AILE161
AASN162

site_idAC3
Number of Residues13
Detailsbinding site for residue YW7 B 301
ChainResidue
BTRP81
BPRO82
BPHE83
BGLN85
BPRO86
BASP88
BLYS91
BLEU92
BASN140
BILE146
BMET149
BHOH406
BHOH414

site_idAC4
Number of Residues17
Detailsbinding site for residue YW7 D 301
ChainResidue
BGLN78
BHOH409
DTRP81
DPRO82
DPHE83
DGLN85
DPRO86
DASP88
DLYS91
DLEU92
DASN140
DILE146
DMET149
DHOH401
DHOH417
DHOH421
DHOH425

site_idAC5
Number of Residues3
Detailsbinding site for residue EDO D 302
ChainResidue
DPHE79
DASP145
DHOH417

site_idAC6
Number of Residues5
Detailsbinding site for residue EDO D 303
ChainResidue
DILE100
DILE101
DLYS102
DTHR103
DASN135

site_idAC7
Number of Residues13
Detailsbinding site for residue YW7 E 301
ChainResidue
ETRP81
EPRO82
EPHE83
EGLN85
EPRO86
EVAL87
EASP88
ELEU92
EASN140
EILE146
EMET149
EHOH403
EHOH427

site_idAC8
Number of Residues6
Detailsbinding site for residue EDO E 302
ChainResidue
DASN116
EILE100
EILE101
ELYS102
ETHR103
EASN135

Functional Information from PROSITE/UniProt
site_idPS00633
Number of Residues60
DetailsBROMODOMAIN_1 Bromodomain signature. AwpFqqpvDavklnlpDYYkiIktpMdmgtIkkrlenny..Ywnaqeciqdfnt.MftNCyiY
ChainResidueDetails
AALA80-TYR139

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsSITE: Acetylated histone binding => ECO:0000269|PubMed:22464331
ChainResidueDetails
AASN140
BASN140
DASN140
EASN140

site_idSWS_FT_FI2
Number of Residues8
DetailsCROSSLNK: Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO2) => ECO:0007744|PubMed:28112733
ChainResidueDetails
ALYS99
BLYS99
DLYS99
ELYS99

229183

PDB entries from 2024-12-18

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