Structure of PDB 4f1z Chain A Binding Site BS02

Receptor Information
>4f1z Chain A (length=322) Species: 282458 (Staphylococcus aureus subsp. aureus MRSA252) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AKGTNVNDKVTASDFKLEKTAFDPNQSGNTFMAANFKVTGQVKSGDYFTA
KLPDSVTGNGDVDYSNSNNTMPIADIKSTNGDVVAKATYDILTKTYTFVF
TDYVNDKENINGQFSLPLFTDRAKAPKSGTYDANINIADEMFDNKITYNY
SSPIAGIDKPNGANISSQIIGVDTASGQNTYKQTVFVNPKQRVLGNTWVY
IKGYQDKIEESSGKVSATDTKLRIFEVNDTSKLSDSYYADPNDSNLKEVT
GEFKDKISYKYDNVASINFGDINKTYVVLVEGHYDNTGKNLKTQVIQENI
DPATGKDYSIFGWNNENVVRYG
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 chain4f1z Chain A Residue 601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB4f1z Crystal Structures Reveal the Multi-Ligand Binding Mechanism of Staphylococcus aureus ClfB
Resolution2.3 Å
Binding residue
(original residue number in PDB)		Y468 Y470
Binding residue
(residue number reindexed from 1)		Y259 Y261
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Cellular Component
GO:0005618 cell wall

View graph for
Biological Process
View graph for
Cellular Component
External links
PDB RCSB:4f1z, PDBe:4f1z, PDBj:4f1z
PDBsum4f1z
PubMed22719251
UniProtQ6GDH2|CLFB_STAAR Clumping factor B (Gene Name=clfB)

[Back to BioLiP]