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BioLiP

Structure of PDB 4z17 Chain A Binding Site BS02

Receptor Information
>4z17 Chain A (length=424) Species: 324602 (Chloroflexus aurantiacus J-10-fl) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MSTLIEAIVAREVLDSRGNPTIEVDVRLESGDVGRAIVPSGASTGAHEAL
ELRDGDKSRYNGKGVLKAVQAVNEDIAEALIGFDAADQIALDQELIALDG
TPNKSKLGANAILGVSLAAAKAAAAAFGLPLYRYLGGVYAHVLPVPMMNI
MNGGQHNSTDFQEFMIMPVGAESFREGLRWGAEIYHMLKKVIHDRGFSTT
VGDEGGFAPSLPTNDAPLQLIMEAIEKAGYRPGEQIVIALDPATTEIFED
GKYHLKREGRSLSSAEMVDYWVDLVNRYPIISLEDGLAEDDWEGWALLRA
KLGDRVQLVGDDFLVTNVQRLQRAIEAKAANSILIKLNQIGSLTETLSAI
QLAQRSGWTAVVSHRSGESEDVTIADLVVATNAGQIKTGAPARTDRIAKY
NQLLRIEEELGSAARYAGRSAFKV
Ligand information
Ligand IDPEP
InChIInChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)
InChIKeyDTBNBXWJWCWCIK-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C=C(C(=O)O)OP(=O)(O)O
CACTVS 3.341OC(=O)C(=C)O[P](O)(O)=O
ACDLabs 10.04O=C(O)C(\OP(=O)(O)O)=C
FormulaC3 H5 O6 P
NamePHOSPHOENOLPYRUVATE
ChEMBLCHEMBL1235228
DrugBankDB01819
ZINCZINC000003870145
PDB chain4z17 Chain A Residue 502 [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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PDB4z17 Biochemical and Structural Characterization of Enolase from Chloroflexus aurantiacus: Evidence for a Thermophilic Origin.
Resolution2.65 Å
Binding residue
(original residue number in PDB)		G41 A42 D313 K338 R367 S368
Binding residue
(residue number reindexed from 1)		G41 A42 D311 K336 R365 S366
Annotation score5
Enzymatic activity
Catalytic site (original residue number in PDB) S43 H156 E165 E206 D243 E286 D313 K338 H366 K389
Catalytic site (residue number reindexed from 1) S43 H156 E163 E204 D241 E284 D311 K336 H364 K387
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:4z17, PDBe:4z17, PDBj:4z17
PDBsum4z17
PubMed26082925
UniProtA9WCM4|ENO_CHLAA Enolase (Gene Name=eno)

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