Structure of PDB 5yps Chain D Binding Site BS01

Receptor Information
>5yps Chain D (length=200) Species: 1408658 (Pneumocystis carinii B80) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TSLDEVADIELEFEKADVELLKHQVELFNPLYEKRAMVLRKIPKFWPIAI
EAAPSDELSVYISPEDANVLEHLIDLRVYRPNEDPRDIKIVFEFEANEYL
ESNSLYLMKLFRYSSQKAEASSSNINKEPSQLISEKVNIEWKKNKDLTRQ
TKGTAPSFFTWFSWTGKENDIFEDEEELAIFIAEDLYPNAVKYFTDALQE
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain5yps Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5yps Structural basis for the acetylation of histone H3K9 and H3K27 mediated by the histone chaperone Vps75 inPneumocystis carinii.
Resolution2.097 Å
Binding residue
(original residue number in PDB)		E192 E194
Binding residue
(residue number reindexed from 1)		E173 E175
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0003682 chromatin binding
GO:0042393 histone binding
GO:0046872 metal ion binding
Biological Process
GO:0006334 nucleosome assembly
Cellular Component
GO:0000785 chromatin
GO:0005634 nucleus

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:5yps, PDBe:5yps, PDBj:5yps
PDBsum5yps
PubMed31098304
UniProtA0A0W4ZF97

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