Structure of PDB 8t0c Chain A Binding Site BS01
Receptor Information
>8t0c Chain A (length=532) Species:
10116
(Rattus norvegicus) [
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YYKGQTALHIAIERRNMTLVTLLVENGADVQAAANGDFFKKTKGRPGFYF
GELPLSLAACTNQLAIVKFLLQNSWQPADISARDSVGNTVLHALVEVADN
TVDNTKFVTSMYNEILILGAKLHPTLKLEEITNRKGLTPLALAASSGKIG
VLAYILQREIHEPECRHLSRKFTEWAYGPVHSSLYDLSCIDTCEKNSVLE
VIAYSSSETPNRHDMLLVEPLNRLLQDKWDRFVKRIFYFNFFVYCLYMII
FTAAAYYRPVEGLPPYKLKNTVGDYFRVTGEILSVSGGVYFFFRGIQYFL
QRRPSLKSLFVDSYSEILFFVQSLFMLVSVVLYFSQRKEYVASMVFSLAM
GWTNMLYYTRGFQQMGIYAVMIEKMILRDLCRFMFVYLVFLFGFSTAVVT
LIEDGKYNSLYSTCLELFKFTIGMGDLEFTENYDFKAVFIILLLAYVILT
YILLLNMLIALMGETVNKIAQESKNIWKLQRAITILDTEKSFLKCMRKAF
RSGKLLQVGFTPDGKDDYRWCFRVDEVNWTTW
Ligand information
Ligand ID
NKN
InChI
InChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/t16-/m1/s1
InChIKey
FAZBDRGXCKPVJU-MRXNPFEDSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.7.0
CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)O
CACTVS 3.370
CCCCCCCCCCCCCC(=O)OC[CH](O)CO[P](O)(O)=O
ACDLabs 12.01
O=P(OCC(O)COC(=O)CCCCCCCCCCCCC)(O)O
OpenEye OEToolkits 1.7.0
CCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)O)O
CACTVS 3.370
CCCCCCCCCCCCCC(=O)OC[C@@H](O)CO[P](O)(O)=O
Formula
C17 H35 O7 P
Name
(2R)-2-hydroxy-3-(phosphonooxy)propyl tetradecanoate;
14:0 LPA;
myristoyl lysophosphatidic acid
ChEMBL
CHEMBL1615121
DrugBank
ZINC
PDB chain
8t0c Chain A Residue 901 [
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Receptor-Ligand Complex Structure
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PDB
8t0c
Structural basis of TRPV1 modulation by endogenous bioactive lipids.
Resolution
3.5 Å
Binding residue
(original residue number in PDB)
Y511 S512 L515 F543 T550 N551 L553 Y554
Binding residue
(residue number reindexed from 1)
Y314 S315 L318 F346 T353 N354 L356 Y357
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0004888
transmembrane signaling receptor activity
GO:0005216
monoatomic ion channel activity
GO:0005230
extracellular ligand-gated monoatomic ion channel activity
GO:0005231
excitatory extracellular ligand-gated monoatomic ion channel activity
GO:0005261
monoatomic cation channel activity
GO:0005262
calcium channel activity
GO:0005515
protein binding
GO:0005516
calmodulin binding
GO:0005524
ATP binding
GO:0008289
lipid binding
GO:0008324
monoatomic cation transmembrane transporter activity
GO:0015276
ligand-gated monoatomic ion channel activity
GO:0015278
intracellularly gated calcium channel activity
GO:0017081
chloride channel regulator activity
GO:0035091
phosphatidylinositol binding
GO:0042802
identical protein binding
GO:0046872
metal ion binding
GO:0051219
phosphoprotein binding
GO:0097603
temperature-gated ion channel activity
Biological Process
GO:0000122
negative regulation of transcription by RNA polymerase II
GO:0001659
temperature homeostasis
GO:0001660
fever generation
GO:0001774
microglial cell activation
GO:0002024
diet induced thermogenesis
GO:0002790
peptide secretion
GO:0003085
negative regulation of systemic arterial blood pressure
GO:0006629
lipid metabolic process
GO:0006811
monoatomic ion transport
GO:0006816
calcium ion transport
GO:0007204
positive regulation of cytosolic calcium ion concentration
GO:0009268
response to pH
GO:0009408
response to heat
GO:0010459
negative regulation of heart rate
GO:0010917
negative regulation of mitochondrial membrane potential
GO:0014047
glutamate secretion
GO:0014832
urinary bladder smooth muscle contraction
GO:0019233
sensory perception of pain
GO:0019722
calcium-mediated signaling
GO:0034220
monoatomic ion transmembrane transport
GO:0034605
cellular response to heat
GO:0043065
positive regulation of apoptotic process
GO:0043434
response to peptide hormone
GO:0045429
positive regulation of nitric oxide biosynthetic process
GO:0048265
response to pain
GO:0048266
behavioral response to pain
GO:0050909
sensory perception of taste
GO:0050954
sensory perception of mechanical stimulus
GO:0050955
thermoception
GO:0050960
detection of temperature stimulus involved in thermoception
GO:0050965
detection of temperature stimulus involved in sensory perception of pain
GO:0050968
detection of chemical stimulus involved in sensory perception of pain
GO:0051289
protein homotetramerization
GO:0055085
transmembrane transport
GO:0060079
excitatory postsynaptic potential
GO:0060083
smooth muscle contraction involved in micturition
GO:0070588
calcium ion transmembrane transport
GO:0071312
cellular response to alkaloid
GO:0071318
cellular response to ATP
GO:0071345
cellular response to cytokine stimulus
GO:0071356
cellular response to tumor necrosis factor
GO:0071363
cellular response to growth factor stimulus
GO:0071468
cellular response to acidic pH
GO:0071502
cellular response to temperature stimulus
GO:0090212
negative regulation of establishment of blood-brain barrier
GO:0098703
calcium ion import across plasma membrane
GO:1901594
response to capsazepine
GO:1990090
cellular response to nerve growth factor stimulus
Cellular Component
GO:0005886
plasma membrane
GO:0009897
external side of plasma membrane
GO:0016020
membrane
GO:0030425
dendrite
GO:0032591
dendritic spine membrane
GO:0042995
cell projection
GO:0043005
neuron projection
GO:0043025
neuronal cell body
GO:0045202
synapse
GO:0045211
postsynaptic membrane
GO:0098982
GABA-ergic synapse
View graph for
Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:8t0c
,
PDBe:8t0c
,
PDBj:8t0c
PDBsum
8t0c
PubMed
38698206
UniProt
O35433
|TRPV1_RAT Transient receptor potential cation channel subfamily V member 1 (Gene Name=Trpv1)
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