Structure of PDB 5xqg Chain H Binding Site BS03

Receptor Information
>5xqg Chain H (length=888) Species: 5076 (Penicillium chrysogenum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FNCTSSSATVHWLGDKPTYHAGVTFGLPWPQGKYRPQETSFSLTGDSELQ
SWATGYWADGSLKWTAHAIAESNQIYDQYTVTASSLGCVSSIVVTDNSDA
LTVNTGEVAVSFPKGGNVIIGDIKTKSGKVIGANGRLVLQSQDSVPDNFD
NRANSPIQYSNFDGNINEVFVNQTSARTLVTVRGNHTVTDGTDHDPWLPF
VVRFYLYANSATIKVMHSIVFDGDENDFITGLGIRFDVPLKGEEYYDRHI
RFAGVDGGIFNEAVQGITGLRRDPGEEIRAAQFAGQKLADTETWEPRVST
RLKWIPTWADYGLTQLTADGFGLKKRTKAGQSWVNIPSGTRAEGLAYLGG
ATQGGLAVGLRDFWKRYPVGLDISNAASDTGELTLWLYSPAAEPLDLRPF
HDGLGQDGYEDQLDALEITYEDWEPGFDTPYGIARTSEVYLFAFDQTPTS
DKLASLTAYMNDPPVLVAEPKYIHETQALGEYWALPGSSPAAATLEDRLQ
FIFDFYKGQIEQRRWYGFLDYGDFMHTYDPDRHTWRYDVGGYAWDNSELS
PDLFFWLYFLRTGSKDAYRFAEALTRHTGEVDVYHIGDWKGLGTRHGVQH
WSDSAKQARISQPQYRKYFFYLSGGDERVGELLEELLDTDKTYGELDPQR
KVRTDGWEPSPNSTVSFGLGTDWSGLAAGWLIEWERRGPRWEEAKTKLTN
TIAGIANLTNGFVTGSGLYDPVTWTLGPPPSDPGNRGNVSISHLNAVFGL
PEVVSEAIAYLADDIPKGFKQAWLDYCYYYHASASEQKDRYGVSFSKISL
LQAHSRLAAYAAYETKNKTLALRAWKDFYASDGLLPDAPWNITHVDGSDV
LVPVDEAAWLATNDIAQYGLAVIQNLAYVSDSLDDYQS
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 chain5xqg Chain H Residue 1003 [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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PDB5xqg Crystal structure of exo-rhamnogalacturonan lyase from Penicillium chrysogenum as a member of polysaccharide lyase family 26
Resolution2.74 Å
Binding residue
(original residue number in PDB)		D562 N585 H616 D621 H639
Binding residue
(residue number reindexed from 1)		D523 N546 H577 D582 H600
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:5xqg, PDBe:5xqg, PDBj:5xqg
PDBsum5xqg
PubMed29574769
UniProtB6H7Q7

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