Structure of PDB 4j0s Chain A

Receptor sequence
>4j0sA (length=127) Species: 9606 (Homo sapiens) [Search protein sequence]
SMNPPPPETSNPNKPKRQTNQLQYLLRVVLKTLWKHQFAWPFQQPVDAVK
LNLPDYYKIIKTPMDMGTIKKRLENNYYWNAQECIQDFNTMFTNCYIYNK
PGDDIVLMAEALEKLFLQKINELPTEE
3D structure
PDB4j0s Optimization of 3,5-dimethylisoxazole derivatives as potent bromodomain ligands.
ChainA
Resolution1.84 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 1H3 A W81 P82 F83 L92 Y139 I146 M149 W40 P41 F42 L51 Y98 I105 M108 MOAD: ic50=0.382uM
PDBbind-CN: -logKd/Ki=6.42,IC50=0.382uM
BindingDB: IC50=382nM,Kd=390nM
External links
PDB RCSB:4j0s, PDBe:4j0s, PDBj:4j0s
PDBsum4j0s
PubMed23517011
UniProtO60885|BRD4_HUMAN Bromodomain-containing protein 4 (Gene Name=BRD4)

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