Structure of PDB 1fvp Chain A Binding Site BS01

Receptor Information
>1fvp Chain A (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)		K61 A63 F65 L72 S78 T81 I84 Y88
Binding residue
(residue number reindexed from 1)		K61 A63 F65 L72 S78 T81 I84 Y88
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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