Structure of PDB 2f7f Chain A Binding Site BS02

Receptor Information
>2f7f Chain A (length=482) Species: 226185 (Enterococcus faecalis V583) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TYADDSLTLHTDMYQINMMQTYWELGRADLHAVFECYFREMPFNHGYAIF
AGLERLVNYLENLTFTESDIAYLREVEEYPEDFLTYLANFEFKCTVRSAL
EGDLVFNNEPLIQIEGPLAQCQLVETALLNMVNFQTLIATKAARIKSVIG
DDPLLEFGTRRAQELDAAIWGTRAAYIGGADATSNVRAGKIFGIPVSGTH
AHSLVQSYGNDYEAFMAYAKTHRDCVFLVDTYDTLKAGVPSAIRVAREMG
DKINFLGVRIDSGDMAYISKRVREQLDEAGFTEAKIYASNDLDENTILNL
KMQKSKIDVWGVGTKLITAYDQPALGAVFKLVSIEGEDGQMKDTIKLSSN
AEKVTTPGKKQVWRITRKSDKKSEGDYVTLWNEDPRQEEEIYMFHPVHTF
INKYVRDFEARPVLQDIFVEGKRVYELPTLDEIKQYAKENLDSLHEEYKR
DLNPQKYPVDLSTDCWNHKMNLLEKVRKDVKH
Ligand information
Ligand IDNIO
InChIInChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)
InChIKeyPVNIIMVLHYAWGP-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)c1cccnc1
OpenEye OEToolkits 1.5.0c1cc(cnc1)C(=O)O
CACTVS 3.341OC(=O)c1cccnc1
FormulaC6 H5 N O2
NameNICOTINIC ACID
ChEMBLCHEMBL573
DrugBankDB00627
ZINCZINC000000001795
PDB chain2f7f Chain A Residue 602 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2f7f Crystal Structure of Enterococcus Faecalis Nicotinate Phosphoribosyltransferase
Resolution2.0 Å
Binding residue
(original residue number in PDB)		H398 I404 K406 P461 D463
Binding residue
(residue number reindexed from 1)		H395 I401 K403 P458 D460
Annotation score5
Enzymatic activity
Enzyme Commision number 6.3.4.21: nicotinate phosphoribosyltransferase.
Gene Ontology
Molecular Function
GO:0004516 nicotinate phosphoribosyltransferase activity
GO:0016757 glycosyltransferase activity
GO:0016874 ligase activity
Biological Process
GO:0009435 NAD biosynthetic process
GO:0019363 pyridine nucleotide biosynthetic process
GO:0034355 NAD salvage
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:2f7f, PDBe:2f7f, PDBj:2f7f
PDBsum2f7f
PubMed
UniProtQ830Y8

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