Structure of PDB 1fvp Chain B Binding Site BS01

Receptor Information
>1fvp Chain B (length=231) Species: 659 (Photobacterium phosphoreum) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MNKWNYGVFFVNFYNKGQQEPSKTMNNALETLRIIDEDTSIYDVINIDDH
YLVKKDSEDKKLAPFITLGEKLYVLATSENTVDIAAKYALPLVFKWDDIN
EERLKLLSFYNASASKYNKNIDLVRHQLMLHVNVNEAETVAKEELKLYIE
NYVACTQPSNFNGSIDSIIQSNVTGSYKDCLSYVANLAGKFDNTVDFLLC
FESMQDQNKKKSVMIDLNNQVIKFRQDNNLI
Ligand information
Ligand IDFMA
InChIInChI=1S/C31H47N4O11P/c1-4-5-6-7-8-9-10-11-12-13-20(15-24(38)39)25-19(3)18(2)14-21-26(25)32-27-29(33-31(42)34-30(27)41)35(21)16-22(36)28(40)23(37)17-46-47(43,44)45/h14,20,22-23,28,36-37,40H,4-13,15-17H2,1-3H3,(H,38,39)(H,34,41,42)(H2,43,44,45)/t20-,22+,23-,28+/m1/s1
InChIKeyZMESPPGIOMLBCU-QPLRPWAESA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=P(O)(O)OCC(O)C(O)C(O)CN2c3cc(c(c(c3N=C1C2=NC(=O)NC1=O)C(CC(=O)O)CCCCCCCCCCC)C)C
CACTVS 3.341CCCCCCCCCCC[C@H](CC(O)=O)c1c(C)c(C)cc2N(C[C@H](O)[C@H](O)[C@H](O)CO[P](O)(O)=O)C3=NC(=O)NC(=O)C3=Nc12
OpenEye OEToolkits 1.5.0CCCCCCCCCCC[C@H](CC(=O)O)c1c(c(cc2c1N=C3C(=O)NC(=O)N=C3N2C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)C)C
OpenEye OEToolkits 1.5.0CCCCCCCCCCCC(CC(=O)O)c1c(c(cc2c1N=C3C(=O)NC(=O)N=C3N2CC(C(C(COP(=O)(O)O)O)O)O)C)C
CACTVS 3.341CCCCCCCCCCC[CH](CC(O)=O)c1c(C)c(C)cc2N(C[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O)C3=NC(=O)NC(=O)C3=Nc12
FormulaC31 H47 N4 O11 P
Name6-(3-TETRADECANOIC ACID) FLAVINE MONONUCLEOTIDE
ChEMBL
DrugBank
ZINCZINC000058631698
PDB chain1fvp Chain A Residue 232 [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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PDB1fvp Structure of flavoprotein FP390 from a luminescent bacterium Photobacterium phosphoreum refined at 2.7 A resolution.
Resolution2.7 Å
Binding residue
(original residue number in PDB)		Y14 M25 I47
Binding residue
(residue number reindexed from 1)		Y14 M25 I47
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016705 oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen
GO:0047646 alkanal monooxygenase (FMN-linked) activity

View graph for
Molecular Function
External links
PDB RCSB:1fvp, PDBe:1fvp, PDBj:1fvp
PDBsum1fvp
PubMed15299728
UniProtP12745|LUXF_PHOPO Non-fluorescent flavoprotein (Gene Name=luxF)

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