Structure of PDB 5y1y Chain A

Receptor sequence
>5y1yA (length=124) Species: 9606 (Homo sapiens) [Search protein sequence]
MNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVKL
NLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNKP
GDDIVLMAEALEKLFLQKINELPT
3D structure
PDB5y1y Discovery of novel BET inhibitors by drug repurposing of nitroxoline and its analogues.
ChainA
Resolution1.912 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 HNQ A V87 L92 L94 C136 N140 I146 V45 L50 L52 C94 N98 I104 MOAD: ic50=0.98uM
PDBbind-CN: -logKd/Ki=6.01,IC50=0.98uM
BindingDB: IC50=980nM
External links
PDB RCSB:5y1y, PDBe:5y1y, PDBj:5y1y
PDBsum5y1y
PubMed29087414
UniProtO60885|BRD4_HUMAN Bromodomain-containing protein 4 (Gene Name=BRD4)

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