Structure of PDB 6nb2 Chain A Binding Site BS01

Receptor Information
>6nb2 Chain A (length=423) Species: 272624 (Legionella pneumophila subsp. pneumophila str. Philadelphia 1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HHMHIHKIQAREILDSRGNPTIEADVTLTTGIIGRASVPSGASTGSREAC
ELRDNDPKRYAGKGVQKAVKHVNNEINQALQGLSVEDQENLDRILCQLDN
TENKSHLGANAILATSLACARARALSLNQPLYMTLNQGDMMTMPVPMMNI
LNGGAHADNNVDIQEFMIMPIGAPDFPVALQMGTEIFHVLKSVLKKQGLN
TAVGDEGGFAPNIQSNRQALDLLSEAIEKAGFRLGEDIVFALDVAASELF
NEGFYHMYSENQKFDSHQLIEYYANLISSYPIVSIEDGLDEKDWSGWKQL
TTHLGNKVQLVGDDLFVTNPKILREGIAQGIANAILIKVNQIGTLSETRQ
AIKLAYDNGYRCVMSHRSGETEDTFIADLAVASGCGQIKTGSLCRTDRTA
KYNQLLRINELASLPYAGKNILK
Ligand information
Ligand ID2PG
InChIInChI=1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1
InChIKeyGXIURPTVHJPJLF-UWTATZPHSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C(C(=O)O)OP(=O)(O)O)O
ACDLabs 10.04O=P(O)(O)OC(C(=O)O)CO
OpenEye OEToolkits 1.5.0C([C@H](C(=O)O)OP(=O)(O)O)O
CACTVS 3.341OC[C@@H](O[P](O)(O)=O)C(O)=O
CACTVS 3.341OC[CH](O[P](O)(O)=O)C(O)=O
FormulaC3 H7 O7 P
Name2-PHOSPHOGLYCERIC ACID
ChEMBL
DrugBankDB01709
ZINCZINC000003869232
PDB chain6nb2 Chain A Residue 501 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6nb2 CRYSTAL STRUCTURE OF ENOLASE FROM LEGIONELLA PNEUMOPHILA BOUND TO 2-PHOSPHOGLYCERIC ACID AND MAGNESIUM
Resolution1.85 Å
Binding residue
(original residue number in PDB)		G39 A40 S41 H154 Q162 E163 E204 D241 D311 K336 H364 R365 S366 K387
Binding residue
(residue number reindexed from 1)		G41 A42 S43 H156 Q164 E165 E206 D243 D313 K338 H366 R367 S368 K389
Annotation score5
Enzymatic activity
Catalytic site (original residue number in PDB) S41 H154 E163 E204 D241 E284 D311 K336 H364 K387
Catalytic site (residue number reindexed from 1) S43 H156 E165 E206 D243 E286 D313 K338 H366 K389
Enzyme Commision number 4.2.1.11: phosphopyruvate hydratase.
Gene Ontology
Molecular Function
GO:0000287 magnesium ion binding
GO:0004634 phosphopyruvate hydratase activity
GO:0016829 lyase activity
GO:0046872 metal ion binding
Biological Process
GO:0006096 glycolytic process
Cellular Component
GO:0000015 phosphopyruvate hydratase complex
GO:0005576 extracellular region
GO:0005737 cytoplasm
GO:0009986 cell surface

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6nb2, PDBe:6nb2, PDBj:6nb2
PDBsum6nb2
PubMed
UniProtQ5ZTX1|ENO_LEGPH Enolase (Gene Name=eno)

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