Structure of PDB 7ddz Chain A Binding Site BS02
Receptor Information
>7ddz Chain A (length=437) Species:
882,9606
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EVQVVLILAYCSIILLGVIGNSLVIHVVIKFKSMRTVTNFFIANLAVADL
LVNTLCLPFTLTYTLMGEWKMGPVLCHLVPYAQGLAVQVSTITLTVIALD
RYRCIVYHLESKISKRISFLIIGLAWGISALLASPLAIFREYSLIEIIPD
FEIVACTEKWPGEEKSIYGTVYSLSSLLILYVLPLGIISFSYTRIWSKLK
NHVAKALIVYGSTTGNTEYTAETIARELADAGYEVDSRDAASVEAGGLFE
GFDLVLLGCSTWGDDSIELQDDFIPLFDSLEETGAQGRKVACFGCGDSSW
EYFCGAVDAIEEKLKNLGAEIVQDGLRIDGDPRAARDDIVGWAHDVRGAI
DHYHQRRQKTTKMLVCVVVVFAVCWLPLHAFQLAVDIDSQVLDLKEYKLI
FTVFHIIAMCSTFANPLLYGWMNSNYRKAFLSAFRCE
Ligand information
Ligand ID
FMN
InChI
InChI=1S/C17H21N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29)/t11-,12+,14-/m0/s1
InChIKey
FVTCRASFADXXNN-SCRDCRAPSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.6
Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)O)O)O)O
OpenEye OEToolkits 1.7.6
Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O
ACDLabs 12.01
N=2C(=O)NC(=O)C3=Nc1cc(C)c(C)cc1N(C=23)CC(O)C(O)C(O)COP(=O)(O)O
CACTVS 3.385
Cc1cc2N=C3C(=O)NC(=O)N=C3N(C[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O)c2cc1C
CACTVS 3.385
Cc1cc2N=C3C(=O)NC(=O)N=C3N(C[C@H](O)[C@H](O)[C@H](O)CO[P](O)(O)=O)c2cc1C
Formula
C17 H21 N4 O9 P
Name
FLAVIN MONONUCLEOTIDE;
RIBOFLAVIN MONOPHOSPHATE
ChEMBL
CHEMBL1201794
DrugBank
DB03247
ZINC
ZINC000003831425
PDB chain
7ddz Chain A Residue 1202 [
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Receptor-Ligand Complex Structure
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PDB
7ddz
Structural basis for ligand recognition of the neuropeptide Y Y 2 receptor.
Resolution
2.8 Å
Binding residue
(original residue number in PDB)
S1008 T1009 T1010 N1012 T1013 S1056 T1057 W1058 G1092 D1093 W1096 F1099 C1100
Binding residue
(residue number reindexed from 1)
S212 T213 T214 N216 T217 S260 T261 W262 G296 D297 W300 F303 C304
Annotation score
4
Enzymatic activity
Enzyme Commision number
3.2.1.17
: lysozyme.
Gene Ontology
Molecular Function
GO:0003796
lysozyme activity
GO:0004930
G protein-coupled receptor activity
GO:0009055
electron transfer activity
GO:0010181
FMN binding
Biological Process
GO:0007186
G protein-coupled receptor signaling pathway
GO:0009253
peptidoglycan catabolic process
GO:0016998
cell wall macromolecule catabolic process
Cellular Component
GO:0016020
membrane
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:7ddz
,
PDBe:7ddz
,
PDBj:7ddz
PDBsum
7ddz
PubMed
33531491
UniProt
P00323
|FLAV_NITV2 Flavodoxin (Gene Name=DVU_2680);
P49146
|NPY2R_HUMAN Neuropeptide Y receptor type 2 (Gene Name=NPY2R)
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