Structure of PDB 5ao7 Chain A Binding Site BS01

Receptor Information
>5ao7 Chain A (length=375) Species: 287 (Pseudomonas aeruginosa) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GQSFEQWRDAFRQQALAGGIDAQTFDRAFAGVQPDPAVVEADRSQPEFTR
PVWKYLEGALDPLRVRQGQARLAQHARILGEVDARYAVDADAVVAIWGME
SNYGSHMGNKNVIRSLATLAYEGRRPEFAHAQLLAALKILQHGDVPASFM
IGSWAGAMGQTQFIPTTHNQYAVDFDGDGKRDIWGSPGDALASTANYLKA
SGWIAGQPWGFEVRLPAGFDYSLAELTIRKPLGEWQGMGVQGVNGGPLPS
GLSGEQASLLLPAGHRGPAFLVLHNFRAILKYNNSSAYALAVGLLADSFK
GGGRIVGAWPLEDVPLSRSQRIELQRQLAARGHDPGAVDGIIGANTRKAI
RACQQEFGWPADGYPTPALLDRLRT
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 chain5ao7 Chain A Residue 1421 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5ao7 Turnover of Bacterial Cell Wall by Sltb3, a Multidomain Lytic Transglycosylase of Pseudomonas Aeruginosa.
Resolution2.09 Å
Binding residue
(original residue number in PDB)		D219 D221 D223 K225 D234
Binding residue
(residue number reindexed from 1)		D174 D176 D178 K180 D189
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0008933 lytic transglycosylase activity
GO:0046872 metal ion binding
Biological Process
GO:0009253 peptidoglycan catabolic process
GO:0009254 peptidoglycan turnover

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Molecular Function
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Biological Process
External links
PDB RCSB:5ao7, PDBe:5ao7, PDBj:5ao7
PDBsum5ao7
PubMed27035839
UniProtQ9HX28

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