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6SE4

Crystal Structure of the first bromodomain of human BRD4 in complex with (+)-JD1, an Organometallic BET Bromodomain Inhibitor

Functional Information from PDB Data
site_idAC1
Number of Residues6
Detailsbinding site for residue EDO A 801
ChainResidue
ALYS91
AASN93
AILE100
AILE138
AHOH904
AHOH921

site_idAC2
Number of Residues16
Detailsbinding site for residue L8W A 802
ChainResidue
ALEU92
ALEU94
ALYS99
ATYR139
AASN140
AASP145
AILE146
AMET149
AEDO803
ADMS805
AHOH916
AHOH924
AHOH936
APRO53
ATRP81
APRO82

site_idAC3
Number of Residues4
Detailsbinding site for residue EDO A 803
ChainResidue
ATYR139
AASN140
AL8W802
AHOH909

site_idAC4
Number of Residues5
Detailsbinding site for residue DMS A 804
ChainResidue
ALYS57
AASN116
AASN117
AASP144
AASP145

site_idAC5
Number of Residues3
Detailsbinding site for residue DMS A 805
ChainResidue
AGLN85
AASP96
AL8W802

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 Residues1
DetailsSITE: Acetylated histone binding => ECO:0000269|PubMed:22464331
ChainResidueDetails
AASN140

site_idSWS_FT_FI2
Number of Residues2
DetailsCROSSLNK: Glycyl lysine isopeptide (Lys-Gly) (interchain with G-Cter in SUMO2) => ECO:0007744|PubMed:28112733
ChainResidueDetails
ALYS99

225946

PDB entries from 2024-10-09

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