Structure of PDB 3sff Chain A

Receptor sequence
>3sffA (length=341) Species: 9606 (Homo sapiens) [Search protein sequence]
LVPVYIYSPEYVSMCDSLAKIPKRASMVHSLIEAYALHKQMRIVKPKVAS
MEEMATFHTDAYLQHLQKVSGIFDYAAAIGGATITAAQCLIDGMCKVAIN
WSGGWHHAKKDEASGFCYLNDAVLGILRLRRKFERILYVDLDLHHGDGVE
DAFSFTSKVMTVSLHKFSPGFFPGTGDVSDVGLGKGRYYSVNVPIQDGIQ
DEKYYQICESVLKEVYQAFNPKAVVLQLGADTIAGDPMCSFNMTPVGIGK
CLKYILQWQLATLILGGGGYNLANTARCWTYLTGVILGKTLSSEIPDHEF
FTAYGPDYVLEITPSCRPDRNEPHRIQQILNYIKGNLKHVV
3D structure
PDB3sff Human HDAC isoform selectivity achieved via exploitation of the acetate release channel with structurally unique small molecule inhibitors.
ChainA
Resolution2.0 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 0DI A I34 G140 W141 H142 H143 G151 F152 C153 D178 H180 F208 G303 G304 Y306 I21 G104 W105 H106 H107 G115 F116 C117 D142 H144 F172 G267 G268 Y270 MOAD: ic50=200nM
PDBbind-CN: -logKd/Ki=6.70,IC50=200nM
BindingDB: IC50=200nM
BS02 ZN A D178 H180 D267 D142 H144 D231
Gene Ontology
Molecular Function
GO:0004407 histone deacetylase activity
GO:0005515 protein binding
GO:0016787 hydrolase activity
GO:0030544 Hsp70 protein binding
GO:0033558 protein lysine deacetylase activity
GO:0046872 metal ion binding
GO:0051879 Hsp90 protein binding
GO:0140297 DNA-binding transcription factor binding
GO:0160008 protein decrotonylase activity
GO:0160009 histone decrotonylase activity
Biological Process
GO:0000122 negative regulation of transcription by RNA polymerase II
GO:0006325 chromatin organization
GO:0007064 mitotic sister chromatid cohesion
GO:0031397 negative regulation of protein ubiquitination
GO:0031647 regulation of protein stability
GO:0032204 regulation of telomere maintenance
GO:0040029 epigenetic regulation of gene expression
Cellular Component
GO:0000118 histone deacetylase complex
GO:0000228 nuclear chromosome
GO:0005634 nucleus
GO:0005654 nucleoplasm
GO:0005694 chromosome
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:3sff, PDBe:3sff, PDBj:3sff
PDBsum3sff
PubMed21723733
UniProtQ9BY41|HDAC8_HUMAN Histone deacetylase 8 (Gene Name=HDAC8)

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