Structure of PDB 9cbh Chain A Binding Site BS02

Receptor Information
>9cbh Chain A (length=624) Species: 7955 (Danio rerio) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ASGSALIFDEEMSRYKLLWTDPECEIEVPERLTVSYEALRTHGLAQRCKA
VPVRQATEQEILLAHSEEYLEAVKQTPGMNVEELMAFSKKYNAVYFHQNI
YHCAKLAAGATLQLVDSVMKREVRNGMALVRPPGHHSQRSAANGFCVFNN
VAFAALYAKKNYNLNRILIVDWDVHHGQGIQYCFEEDPSVLYFSWHRYEH
QSFWPNLPESDYSSVGKGKGSGFNINLPWNKVGMTNSDYLAAFFHVLLPV
AYEFDPELVIVSAGFDSAIGDPEGEMCALPEIFAHLTHLLMPLAAGKMCV
VLEGGYNLTSLGQSVCQTVHSLLGDPTPRISGLGTACDSALESIQNVRNV
QSSYWSSFKHLAQIVWPEPLKRASVRTVVVPPPGVELTLPKNCQHSGDIS
ESTAKEVQRIRDKHFHDLTDQNILRSLGNIISVLDRMMRSDEVCNGCVVV
SDLSVSVQCALQHALTEPAERVLVVYVGDGELPVKTNDGKVFLVQICTKK
CVNRLTLCLESLTAGFMQALLGLILPVAYEFNPALVLGIVEEMRVWGHMT
CLIQGLARGRMLTLLQGYDKDLLELTVSALSGASISPLGPLRAPKPEDVE
MMEKQRQRLQERWGLLRCTVSESW
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain9cbh Chain A Residue 706 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB9cbh Design, Synthesis, and Structural Evaluation of Acetylated Phenylthioketone Inhibitors of HDAC10
Resolution2.8 Å
Binding residue
(original residue number in PDB)		D174 H176 D267
Binding residue
(residue number reindexed from 1)		D173 H175 D266
Annotation score1
External links
PDB RCSB:9cbh, PDBe:9cbh, PDBj:9cbh
PDBsum9cbh
PubMed
UniProtF1QCV2|HDA10_DANRE Polyamine deacetylase HDAC10 (Gene Name=hdac10)

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