Structure of PDB 4f8l Chain A Binding Site BS03

Receptor Information
>4f8l Chain A (length=138) Species: 632 (Yersinia pestis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NTFHVDFAPNTGEIFAGKQPGDVTMFTLTMGDTAPHGGWRLIPTGDSKGG
YMISADGDYVGLYSYMMSWVGIDNNWYINDDSPKDIKDHLYVKAGTVLKP
TTYKFTGRVEEYVFDNKQSTVINSKDVSGEVTVKQGLE
Ligand information
Ligand IDGLY
InChIInChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)
InChIKeyDHMQDGOQFOQNFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C(=O)O)N
CACTVS 3.341NCC(O)=O
ACDLabs 10.04O=C(O)CN
FormulaC2 H5 N O2
NameGLYCINE
ChEMBLCHEMBL773
DrugBankDB00145
ZINCZINC000004658552
PDB chain4f8l Chain A Residue 240 [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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PDB4f8l Structural basis for the specific recognition of dual receptors by the homopolymeric pH 6 antigen (Psa) fimbriae of Yersinia pestis.
Resolution1.5 Å
Binding residue
(original residue number in PDB)		Y64 W70
Binding residue
(residue number reindexed from 1)		Y63 W69
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:4f8l, PDBe:4f8l, PDBj:4f8l
PDBsum4f8l
PubMed23277582
UniProtP31522|PSAA_YERPE pH 6 antigen (Gene Name=psaA)

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