Structure of PDB 4awy Chain B Binding Site BS03

Receptor Information
>4awy Chain B (length=270) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ASRGCADDAGWNDPAMPLKVYGNTWYVGTCGISALLVTSDAGHILVDAAT
PQAGPQILANIRALGFRPEDVRAIVFSHEHFDHAGSLAELQKATGAPVYA
RAPAIDTLKRGLPDRTDPQFEVAEPVAPVANIVTLADDGVVSVGPLALTA
VASPGHTPGGTSWTWRSCEGDDCRQMVYADSLTAISDDVFRYSDDAAHPG
YLAAFRNTLARVAALDCDILVTPHPSASGLWNRIGPRAAAPLMDTTACRR
YAQGARQRLEKRLAEEAATS
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain4awy Chain B Residue 3230 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4awy Crystal Structure of the Mobile Metallo-Beta-Lactamase Aim-1 from Pseudomonas Aeruginosa: Insights Into Antibiotic Binding and the Role of Gln157
Resolution1.6 Å
Binding residue
(original residue number in PDB)		P89 Q90 G92 E127
Binding residue
(residue number reindexed from 1)		P51 Q52 G54 E89
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links