Structure of PDB 7moz Chain B

Receptor sequence
>7mozB (length=366) Species: 9606 (Homo sapiens) [Search protein sequence]
KKVCYYYDGDIGNYYYGQGHPMKPHRIRMTHNLLLNYGLYRKMEIYRPHK
ATAEEMTKYHSDEYIKFLRSIRPDNMSEYSKQMQRFNVGEDCPVFDGLFE
FCQLSTGGSVAGAVKLNRQQTDMAVNWAGGLHHAKKSEASGFCYVNDIVL
AILELLKYHQRVLYIDIDIHHGDGVEEAFYTTDRVMTVSFHKYGEYFPGT
GDLRDIGAGKGKYYAVNFPMRDGIDDESYGQIFKPIISKVMEMYQPSAVV
LQCGADSLSGDRLGCFNLTVKGHAKCVEVVKTFNLPLLMLGGGGYTIRNV
ARCWTYETAVALDCEIPNELPYNDYFEYFGPDFKLHISPSNMTNQNTPEY
MEKIKQRLFENLRMLP
3D structure
PDB7moz Discovery of macrocyclic HDACs 1, 2, and 3 selective inhibitors for HIV latency reactivation.
ChainB
Resolution1.543 Å
3D
structure
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Enzymatic activity
Enzyme Commision number 3.5.1.-
3.5.1.98: histone deacetylase.
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 ZN B D177 H179 D265 D168 H170 D256
BS02 CA B D175 D177 H179 S198 F199 D166 D168 H170 S189 F190
BS03 CA B F188 T191 V194 Y223 F179 T182 V185 Y214
BS04 ZL4 B G28 H29 P30 E99 D100 H141 H142 G150 F151 H179 F206 L272 G302 Y304 G19 H20 P21 E90 D91 H132 H133 G141 F142 H170 F197 L263 G293 Y295
Gene Ontology
Molecular Function
GO:0004407 histone deacetylase activity

View graph for
Molecular Function
External links
PDB RCSB:7moz, PDBe:7moz, PDBj:7moz
PDBsum7moz
PubMed34091041
UniProtQ92769|HDAC2_HUMAN Histone deacetylase 2 (Gene Name=HDAC2)

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