Structure of PDB 5d5d Chain A Binding Site BS01

Receptor Information
>5d5d Chain A (length=403) Species: 208964 (Pseudomonas aeruginosa PAO1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KNFGLDVKITGESENDRDLGTAPGGTLNDIGIDLRPWAFGQWGDWSAYFM
GQAVAATDKSYLAAREFWVDYAGLTAYPGEHLRFGRQRLREDSGQWQDTN
IEALNWSFETTLLNAHAGVAQRFSEYRTKDRTHVFGDISTQWAPHHRIGV
RIHHADDSGHLRRPGEEVDNLDKTYTGQLTWLGIEATGDAYNYRSSMPLN
YWASATWLTGDRDNLTTTTVDDRRIATGKQSGDVNAFGVDLGLRWNIDEQ
WKAGVGYARGSGGGKDGEEQFQQTGLESNRSNFTGTRSRVHRFGEAFRGE
LSNLQAATLFGSWQLREDYDASLVYHKFWRVDDDSDIGTSGINAALQPGE
KDIGQELDLVVTKYFKQSALIRFRGGLFKPGDAYGPGTDSTMHRAFVDFI
WRF
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 chain5d5d Chain A Residue 503 [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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PDB5d5d In meso in situ serial X-ray crystallography of soluble and membrane proteins at cryogenic temperatures.
Resolution2.4 Å
Binding residue
(original residue number in PDB)		D55 D57 A61 G63
Binding residue
(residue number reindexed from 1)		D16 D18 A22 G24
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:5d5d, PDBe:5d5d, PDBj:5d5d
PDBsum5d5d
PubMed26894538
UniProtP18895|ALGE_PSEAE Alginate production protein AlgE (Gene Name=algE)

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