Structure of PDB 6mo8 Chain A

Receptor sequence
>6mo8A (length=114) Species: 9606 (Homo sapiens) [Search protein sequence]
RVTNQLQYLHKVVMKALWKHQFAWPFRQPVDAVKLGLPDYHKIIKQPMDM
GTIKRRLENNYYWAASECMQDFNTMFTNCYIYNKPTDDIVLMAQTLEKIF
LQKVASMPQEEQEL
3D structure
PDB6mo8 Structure-guided discovery of a novel, potent, and orally bioavailable 3,5-dimethylisoxazole aryl-benzimidazole BET bromodomain inhibitor.
ChainA
Resolution1.8 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 JWD A W97 F99 L108 N156 I162 W24 F26 L35 N83 I89 PDBbind-CN: -logKd/Ki=5.84,IC50=1430nM
BS02 JWD A N77 Q80 L187 N4 Q7 L114 PDBbind-CN: -logKd/Ki=5.84,IC50=1430nM
External links
PDB RCSB:6mo8, PDBe:6mo8, PDBj:6mo8
PDBsum6mo8
PubMed30606676
UniProtP25440|BRD2_HUMAN Bromodomain-containing protein 2 (Gene Name=BRD2)

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