Structure of PDB 5cpe Chain A

Receptor sequence
>5cpeA (length=130) Species: 9606 (Homo sapiens) [Search protein sequence]
HLVPRGSNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQP
VDAVKLNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNC
YIYNKPGDDIVLMAEALEKLFLQKINELPT
3D structure
PDB5cpe Discovery of Benzo[cd]indol-2(1H)-ones as Potent and Specific BET Bromodomain Inhibitors: Structure-Based Virtual Screening, Optimization, and Biological Evaluation
ChainA
Resolution1.62 Å
3D
structure
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Enzymatic activity
Enzyme Commision number ?
Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 EB2 A W81 P82 F83 L92 L94 N140 I146 M149 W45 P46 F47 L56 L58 N104 I110 M113 MOAD: ic50=0.45uM
BindingDB: IC50=450nM
External links
PDB RCSB:5cpe, PDBe:5cpe, PDBj:5cpe
PDBsum5cpe
PubMed26731490
UniProtO60885|BRD4_HUMAN Bromodomain-containing protein 4 (Gene Name=BRD4)

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