Structure of PDB 7alz Chain A Binding Site BS02

Receptor Information
>7alz Chain A (length=194) Species: 33995 (Komagataeibacter europaeus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GERIIAFQGRPGAYSDLACRQARPGWTTLPCQTFAQTIAAVHDGRAELAM
LACENSLAGRVPDIHALLPEAGLFIVGEHFQRVHNTTRFYIASRRPATLP
PPGPGFMTTLLFRVNNQPGALYKALGGLATAGVNMTRLESYMLEGSFSAT
QFLMDVEGHPEAPPLARALDELSFFSEQQEILGVYPASPFRRKP
Ligand information
Ligand IDPHE
InChIInChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1
InChIKeyCOLNVLDHVKWLRT-QMMMGPOBSA-N
SMILES
SoftwareSMILES
CACTVS 3.341N[CH](Cc1ccccc1)C(O)=O
CACTVS 3.341N[C@@H](Cc1ccccc1)C(O)=O
OpenEye OEToolkits 1.5.0c1ccc(cc1)CC(C(=O)O)N
OpenEye OEToolkits 1.5.0c1ccc(cc1)C[C@@H](C(=O)O)N
ACDLabs 10.04O=C(O)C(N)Cc1ccccc1
FormulaC9 H11 N O2
NamePHENYLALANINE
ChEMBLCHEMBL301523
DrugBankDB00120
ZINCZINC000000105196
PDB chain7alz Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7alz The Komagataeibacter europaeus GqqA is the prototype of a novel bifunctional N-Acyl-homoserine lactone acylase with prephenate dehydratase activity.
Resolution1.67 Å
Binding residue
(original residue number in PDB)		N221 M222 T223 R224
Binding residue
(residue number reindexed from 1)		N134 M135 T136 R137
Annotation score1
Enzymatic activity
Enzyme Commision number 4.2.1.51: prephenate dehydratase.
Gene Ontology
Molecular Function
GO:0004106 chorismate mutase activity
GO:0004664 prephenate dehydratase activity
GO:0016787 hydrolase activity
GO:0016829 lyase activity
Biological Process
GO:0009094 L-phenylalanine biosynthetic process
GO:0009372 quorum sensing
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:7alz, PDBe:7alz, PDBj:7alz
PDBsum7alz
PubMed34112823
UniProtA0A0M0ELU2

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