Structure of PDB 7kr9 Chain A Binding Site BS02

Receptor Information
>7kr9 Chain A (length=453) Species: 373153 (Streptococcus pneumoniae D39) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SNFAIILAAGKGTRMKSDLPKVLHKVAGISMLEHVFRSVGAIQPEKTVTV
VGHKAELVEETEFVTQSEQLGTGHAVMMTEPILEGLSGHTLVIAGDTPLI
TGESLKNLIDFHINHKNVATILTAETDNPFGYGRIVRNDNAEVLRIVEQK
DATDFEKQIKEINTGTYVFDNERLFEALKNINTNNAQGEYYITDVIGIFR
ETGEKVGAYTLKDFDESLGVNDRVALATAESVMRRRINHKHMVNGVSFVN
PEATYIDIDVEIAPEVQIEANVILKGQTKIGAETVLTNGTYVVDSTIGAG
AVITNSMIEESSVADGVTVGPYAHIRPNSSLGAQVHIGNFVEVKGSSIGE
NTKAGHLTYIGNCEVGSNVNFGAGTITVNYDGKNKYKTVIGDNVFVGSNS
TIIAPVELGDNSLVGAGSTITKDVPADAIAIGRGRQINKDEYATRLPHHP
KNQ
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain7kr9 Chain A Residue 1904 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7kr9 Dysregulation of Streptococcus pneumoniae zinc homeostasis breaks ampicillin resistance in a pneumonia infection model.
Resolution1.9 Å
Binding residue
(original residue number in PDB)		E315 H330
Binding residue
(residue number reindexed from 1)		E309 H324
Annotation score1
Enzymatic activity
Enzyme Commision number 2.3.1.157: glucosamine-1-phosphate N-acetyltransferase.
2.7.7.23: UDP-N-acetylglucosamine diphosphorylase.
Gene Ontology
Molecular Function
GO:0000287 magnesium ion binding
GO:0003977 UDP-N-acetylglucosamine diphosphorylase activity
GO:0016740 transferase activity
GO:0016746 acyltransferase activity
GO:0016779 nucleotidyltransferase activity
GO:0019134 glucosamine-1-phosphate N-acetyltransferase activity
GO:0046872 metal ion binding
Biological Process
GO:0000902 cell morphogenesis
GO:0006048 UDP-N-acetylglucosamine biosynthetic process
GO:0008360 regulation of cell shape
GO:0009058 biosynthetic process
GO:0009245 lipid A biosynthetic process
GO:0009252 peptidoglycan biosynthetic process
GO:0071555 cell wall organization
Cellular Component
GO:0005737 cytoplasm

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:7kr9, PDBe:7kr9, PDBj:7kr9
PDBsum7kr9
PubMed35021083
UniProtQ04KU2|GLMU_STRP2 Bifunctional protein GlmU (Gene Name=glmU)

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