Structure of PDB 6day Chain D Binding Site BS04

Receptor Information
>6day Chain D (length=273) Species: 380358 (Xanthomonas albilineans GPE PC73) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TSPRLDCAGRILTLDRPRVMGIVNVTPDSFSDGGTHTTVEAAVAHGLRLA
EEGADLLDIGGESTRPGATAVPVEEELRRVIPVIERLVAQTALPLSVDTF
KPEVMRAAVAAGAGMINDVQALRQPGALDAVADLRVPVVLMHMPGDAPHY
DDVVAEVHRFLVERIFAAEMAGIDKRRLLIDPGFGFGKSTADNVQLLAHL
PRLCELGVPVLAGLSRKRSIGELTGRELPEQRVAGSVAAHLLAAQRGALL
LRVHDVAATVDALTVWQAVQAVP
Ligand information
Ligand IDPAB
InChIInChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)
InChIKeyALYNCZNDIQEVRV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341Nc1ccc(cc1)C(O)=O
ACDLabs 10.04O=C(O)c1ccc(N)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1C(=O)O)N
FormulaC7 H7 N O2
Name4-AMINOBENZOIC ACID
ChEMBLCHEMBL542
DrugBankDB02362
ZINCZINC000000000920
PDB chain6day Chain D Residue 403 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6day Xanthomonas albilineans Dihydropteroate synthase with 4-aminobenzoic acid
Resolution1.65 Å
Binding residue
(original residue number in PDB)		A47 H48 R51
Binding residue
(residue number reindexed from 1)		A44 H45 R48
Annotation score5
Enzymatic activity
Enzyme Commision number 2.5.1.15: dihydropteroate synthase.
Gene Ontology
Molecular Function
GO:0004156 dihydropteroate synthase activity
GO:0016740 transferase activity
GO:0046872 metal ion binding
Biological Process
GO:0009396 folic acid-containing compound biosynthetic process
GO:0042558 pteridine-containing compound metabolic process
GO:0044237 cellular metabolic process
GO:0046654 tetrahydrofolate biosynthetic process
GO:0046656 folic acid biosynthetic process
Cellular Component
GO:0005829 cytosol

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6day, PDBe:6day, PDBj:6day
PDBsum6day
PubMed
UniProtD2UDM3

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