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6DUV

Crystal structure of the second bromodomain of human BRD4 in complex with MS417 inhibitor

Functional Information from PDB Data
site_idAC1
Number of Residues12
Detailsbinding site for residue 0S6 A 501
ChainResidue
ATRP374
AHOH611
AHOH666
BTRP374
APRO375
APHE376
ALEU387
AASN433
AGLU438
AVAL439
A0S6502
AHOH608

site_idAC2
Number of Residues15
Detailsbinding site for residue 0S6 A 502
ChainResidue
ALEU385
ASER405
AGLU408
AALA409
AARG410
ATYR432
APRO434
AHIS437
A0S6501
AHOH623
AHOH640
BTRP374
BALA384
BLEU385
BEDO504

site_idAC3
Number of Residues3
Detailsbinding site for residue EDO A 503
ChainResidue
ALEU354
ASER358
AHOH618

site_idAC4
Number of Residues7
Detailsbinding site for residue EDO A 504
ChainResidue
ALEU424
ASER427
AHOH603
AHOH606
AHOH632
BARG423
BPHE454

site_idAC5
Number of Residues11
Detailsbinding site for residue 0S6 B 501
ChainResidue
ALEU385
AGLU411
BTRP374
BPRO375
BPHE376
BASN433
BHIS437
BVAL439
BMET442
BHOH608
BHOH609

site_idAC6
Number of Residues3
Detailsbinding site for residue EDO B 503
ChainResidue
AHIS396
APRO397
BHOH619

site_idAC7
Number of Residues6
Detailsbinding site for residue EDO B 504
ChainResidue
AHIS437
AGLU438
A0S6502
BHOH606
BHOH655
BHOH660

site_idAC8
Number of Residues3
Detailsbinding site for residue EDO B 505
ChainResidue
BALA366
BLYS367
BLYS368

site_idAC9
Number of Residues4
Detailsbinding site for residue EDO B 506
ChainResidue
BPHE365
BLYS404
BHOH603
BHOH657

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsSITE: Acetylated histone binding => ECO:0000269|PubMed:22464331
ChainResidueDetails
AASN433
BASN433

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PDB entries from 2024-11-06

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