Structure of PDB 5yqx Chain A

Receptor sequence
>5yqxA (length=126) Species: 9606 (Homo sapiens) [Search protein sequence]
GSNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVK
LNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNK
PGDDIVLMAEALEKLFLQKINELPTE
3D structure
PDB5yqx Benzoxazinone-containing 3,5-dimethylisoxazole derivatives as BET bromodomain inhibitors for treatment of castration-resistant prostate cancer.
ChainA
Resolution1.82 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 E0K A W81 P82 F83 L92 N140 I146 W40 P41 F42 L51 N99 I105 PDBbind-CN: -logKd/Ki=6.96,Kd=110nM
BindingDB: Kd=110nM,IC50=100nM
External links
PDB RCSB:5yqx, PDBe:5yqx, PDBj:5yqx
PDBsum5yqx
PubMed29758518
UniProtO60885|BRD4_HUMAN Bromodomain-containing protein 4 (Gene Name=BRD4)

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