Structure of PDB 8yku Chain A Binding Site BS03

Receptor Information
>8yku Chain A (length=304) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FELIRRFFAAAACAAPAADVALGIGDDCALLAPPAGEQLAVSTDTLVEGV
HFPAGCDPFLLAQRALAVSASDLAAMGAAPLAFTLALTLPQADAEWLQGF
ARGLDAMARQCGLALVGGDTTRGPLSMTLTVFGRVPAGQALTRAGARPGD
LLCVGGPLGEAGAALELVLERRSAPAEVAEPLLARYWTPAPQFGLGLALR
GKASAALDISDGLLADCGHIARASGVALLVECQRLQASAALSGLLAGEEA
LRQQLAAGDDYVLVFTLPPEYLGEIRAAWPAMAVIGRVEAGQGVHLLDAD
GKEL
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 chain8yku Chain A Residue 405 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8yku ThiL in complex with AMP-PNP
Resolution2.17 Å
Binding residue
(original residue number in PDB)		D47 D75
Binding residue
(residue number reindexed from 1)		D44 D72
Annotation score1
External links