Structure of PDB 7wlt Chain E Binding Site BS02

Receptor Information
>7wlt Chain E (length=1353) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LDLAASFSAVLTRIQVFVRRLLELHVFKLVALYTVWVALKEVSVMNLLLV
VLWAFALPYPRFRPMASCLSTVWTCIIIVCKMLYQLKIVNPNCTEPFPQP
LEINQSLLYRGPVDPANWFGVRKGYPNLGYIQNHLQILLLLVFEAVVYRR
QEHYRRQHRQRLDQDLLSCLKYFINFFFYKFGLEICFLMAVNVIGQRMNF
MVILHGCWLVAILTRRRREAIARLWPNYCLFLTLFLLYQYLLCLGMNSAL
IKWLYLPDFFRAPNSTNLISDFLLLLCASQQWQVFSAERTEEWQRGEPNP
IPNFIHCRSYLDMLKVAVFRYLFWLVLVVVFVAGATRISIFGLGYLLACF
YLLLFGTTLLQKDTRAQLVLWDCLILYNVTVIISKNMLSLLSCVFVEQMQ
SNFCWVIQLFSLVCTVKGYYDPKEMMTRDRDCLLPVEEAGIIWDSICFFF
LLLQRRIFLSHYFLHVSADLKATALQASRGFALYNAANLKSINFHRQIEE
KSLAQLKRQMKRIRAKQEKYRQSQASDHATVIHSGDYFLFESDSEEHMMQ
RVLSTMQFLWVLGQATVDGLTRWLRAFTKHHRTMSDVLCAERYLLTQELL
RVGEVRRGVLDQLASELLLDRRLHIPELEEAERFEAQQGRTLRLLRAGYQ
CVAAHSELLCYFIIILNHMVTASAASLVLPVLVFLWAMLTIPRPSKRFWM
TAIVFTEVMVVTKYLFQFGFFPWNSYVVLRRYENKPYFPPRILGLEKTDS
YIKYDLVQLMALFFHRSQLLCYGLWFCVSLAQSFYQPLQRFFHDILHTKY
RAATDVYALMFLADIVDIIIIIFGFWAFQVPQAFLFMLLVQFGTMVIDRA
LYLRKTVLGKLAFQVVLVVAIHIWMFFILPAVTERMFSQNAVAQLWYFVK
CIYFALSAYQIRCGYPTRILGNFLTKKYNHLNLFLFQGFRLVPFLVELRA
VMDWVWTDTTLSLSNWMCVEDIYANIFIIKCSRETEKKYPQPKGQKKKKI
VKYGMGGLIILFLIAIIWFPLLFMSLIRSVVGVVNQPIDVTVTLKLGGYE
PLFTMSAQQPSIVPFTPQAYEELSQQFDPYPLAMQFISQYSPEDIVTAQI
EGSSGALWRISPPSRAQMKQELYNGTADITLRFTWNFQRDLAKGGTVEYT
NEKHTLELAPNSTARRQLAQLLEGRPDQSVVIPHLFPKYIRAPNGPEANP
VKQLQPDEEEDYLGVRIQLRREQVGGTKASDFLEWWVIELQDCKADCNLL
PMVIFSDKVSPPSLGFLAGYGIVGLYVSIVLVVGKFVRGFFSEISHSIMF
EELPCVDRILKLCQDIFLVRETRELELEEELYAKLIFLYRSPETMIKWTR
ERE
Ligand information
Ligand IDPLX
InChIInChI=1S/C42H88NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h40-42,44-45H,6-39H2,1-5H3/p+1/t40-,41+,42+/m1/s1
InChIKeyYVNJQRQLQPWVSQ-IWSHAHEXSA-O
SMILES
SoftwareSMILES
CACTVS 3.341CCCCCCCCCCCCCCCCC[C@@H](O)O[C@H](CO[C@H](O)CCCCCCCCCCCCCCC)CO[P@@](O)(=O)OCC[N+](C)(C)C
OpenEye OEToolkits 1.5.0CCCCCCCCCCCCCCCCCC(O)OC(COC(CCCCCCCCCCCCCCC)O)COP(=O)(O)OCC[N+](C)(C)C
CACTVS 3.341CCCCCCCCCCCCCCCCC[CH](O)O[CH](CO[CH](O)CCCCCCCCCCCCCCC)CO[P](O)(=O)OCC[N+](C)(C)C
ACDLabs 10.04O=P(OCC(OC(O)CCCCCCCCCCCCCCCCC)COC(O)CCCCCCCCCCCCCCC)(OCC[N+](C)(C)C)O
OpenEye OEToolkits 1.5.0CCCCCCCCCCCCCCCCC[C@@H](O)O[C@H](CO[C@@H](CCCCCCCCCCCCCCC)O)CO[P@](=O)(O)OCC[N+](C)(C)C
FormulaC42 H89 N O8 P
Name(9R,11S)-9-({[(1S)-1-HYDROXYHEXADECYL]OXY}METHYL)-2,2-DIMETHYL-5,7,10-TRIOXA-2LAMBDA~5~-AZA-6LAMBDA~5~-PHOSPHAOCTACOSANE-6,6,11-TRIOL
ChEMBL
DrugBank
ZINCZINC000058638459
PDB chain7wlt Chain C Residue 2609 [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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PDB7wlt Structure deformation and curvature sensing of PIEZO1 in lipid membranes.
Resolution3.46 Å
Binding residue
(original residue number in PDB)		I2033 T2042
Binding residue
(residue number reindexed from 1)		I847 T856
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005261 monoatomic cation channel activity
GO:0005515 protein binding
GO:0008381 mechanosensitive monoatomic ion channel activity
GO:0042802 identical protein binding
GO:0140135 mechanosensitive monoatomic cation channel activity
Biological Process
GO:0006812 monoatomic cation transport
GO:0010831 positive regulation of myotube differentiation
GO:0033625 positive regulation of integrin activation
GO:0033634 positive regulation of cell-cell adhesion mediated by integrin
GO:0034220 monoatomic ion transmembrane transport
GO:0042391 regulation of membrane potential
GO:0050982 detection of mechanical stimulus
GO:0098655 monoatomic cation transmembrane transport
Cellular Component
GO:0005783 endoplasmic reticulum
GO:0005789 endoplasmic reticulum membrane
GO:0005886 plasma membrane
GO:0016020 membrane
GO:0031258 lamellipodium membrane
GO:0032420 stereocilium
GO:0032437 cuticular plate
GO:0033116 endoplasmic reticulum-Golgi intermediate compartment membrane
GO:0042995 cell projection

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Molecular Function
View graph for
Biological Process
View graph for
Cellular Component
External links
PDB RCSB:7wlt, PDBe:7wlt, PDBj:7wlt
PDBsum7wlt
PubMed35388220
UniProtE2JF22|PIEZ1_MOUSE Piezo-type mechanosensitive ion channel component 1 (Gene Name=Piezo1)

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