Structure of PDB 4b61 Chain B Binding Site BS06

Receptor Information
>4b61 Chain B (length=439) Species: 208964 (Pseudomonas aeruginosa PAO1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
APKNFGLDVKITGESENDRDLGTAPGGTLNDIGIDLRPWAFGQWGDWSAY
FMGQAVAATDTIETDTLQDGREPDKSYLAAREFWVDYAGLTAYPGEHLRF
GRQRLREDSGQWQDTNIEALNWSFETTLLNAHAGVAQRFSEYRTDLDELA
PEDKDRTHVFGDISTQWAPHHRIGVRIHHADDSGHLRRPGEEVDNLDKTY
TGQLTWLGIEATGDAYNYRSSMPLNYWASATWLTGDRDNLTTTTVDDRRI
ATGKQSGDVNAFGVDLGLRWNIDEQWKAGVGYARGSGGGKDGEEQFQQTG
LESNRSNFTGTRSRVHRFGEAFRGELSNLQAATLFGSWQLREDYDASLVY
HKFWRVDDDSDIGTSGINAALQPGEKDIGQELDLVVTKYFKQGLLPASMS
QYVDEPSALIRFRGGLFKPGDAYTDSTMHRAFVDFIWRF
Ligand information
Ligand IDCU
InChIInChI=1S/Cu/q+2
InChIKeyJPVYNHNXODAKFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Cu+2]
CACTVS 3.341[Cu++]
FormulaCu
NameCOPPER (II) ION
ChEMBL
DrugBankDB14552
ZINC
PDB chain4b61 Chain B Residue 1499 [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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PDB4b61 A Conformational Landscape for Alginate Secretion Across the Outer Membrane of Pseudomonas Aeruginosa.
Resolution2.402 Å
Binding residue
(original residue number in PDB)
D55 D57 G63
Binding residue
(residue number reindexed from 1)
D18 D20 G26
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0042121 alginic acid biosynthetic process
Cellular Component
GO:0009279 cell outer membrane

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Biological Process

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Cellular Component
External links
PDB RCSB:4b61, PDBe:4b61, PDBj:4b61
PDBsum4b61
PubMed25084326
UniProtP18895|ALGE_PSEAE Alginate production protein AlgE (Gene Name=algE)

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