Structure of PDB 1jze Chain A Binding Site BS02

Receptor Information
>1jze Chain A (length=128) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AECSVDIQGNDQMQFNTNAITVDKSCKQFTVNLSHPGNLPKNVMGHNWVL
STAADMQGVVTDGMASGLDKDYLKPDDSRVIAHTKLIGSGEKDSVTFDVS
KLKEGEQYMFFCTFPGHSALMKGTLTLK
Ligand information
Ligand IDDRU
InChIInChI=1S/2C10H8N2.C3H3N2.Ru/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-5-3-4-1;/h2*1-8H;1-3H;/q;;-1;+3
InChIKeyZSRBWSVKDUMHBO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01n1ccn(c1)[Ru+2]73(n4c(c2ccccn23)cccc4)n5ccccc5c6ccccn67
CACTVS 3.370[Ru++]|1|2(|n3ccccc3c4ccccn|14)(|n5ccccc5c6ccccn|26)n7ccnc7
OpenEye OEToolkits 1.7.2c1cn(cn1)[Ru+2]23([N]4=C(C=CC=C4)C5=CC=CC=[N]52)[N]6=CC=CC=C6C7=CC=CC=[N]37
FormulaC23 H19 N6 Ru
NameDELTA-BIS(2,2'-BIPYRIDINE)IMIDAZOLE RUTHENIUM (II)
ChEMBL
DrugBankDB03871
ZINC
PDB chain1jze Chain A Residue 903 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1jze Electron tunneling in single crystals of Pseudomonas aeruginosa azurins.
Resolution1.6 Å
Binding residue
(original residue number in PDB)
K74 D76 D77 V80 H83
Binding residue
(residue number reindexed from 1)
K74 D76 D77 V80 H83
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005507 copper ion binding
GO:0005515 protein binding
GO:0008270 zinc ion binding
GO:0009055 electron transfer activity
GO:0042802 identical protein binding
GO:0046872 metal ion binding
GO:0046914 transition metal ion binding
Cellular Component
GO:0042597 periplasmic space

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Molecular Function

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Cellular Component
External links
PDB RCSB:1jze, PDBe:1jze, PDBj:1jze
PDBsum1jze
PubMed11716717
UniProtP00282|AZUR_PSEAE Azurin (Gene Name=azu)

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