Structure of PDB 8tr5 Chain B Binding Site BS03

Receptor Information
>8tr5 Chain B (length=553) Species: 10114 (Rattus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SWNDVFQYETNKVTRIQSVNYGTIKWILHMTVFSYVSFALMSDKLYQRKE
PLISSVHTKVKGVAEVTEKLVHGIFDTADYTLPLQGNSFFVMTNYLKSEG
QEQKLCPEYPSRGKQCHSDQGCIKGWMDPQSKGIQTGRCIPYDQKRKTCE
IFAWCPAEEGKEAPRPALLRSAENFTVLIKNNIDFPGHNYTTRNILPGMN
ISCTFHKTWNPQCPIFRLGDIFQEIGENFTEVAVQGGIMGIEIYWDCNLD
SWSHRCQPKYSFRRLDDKYTNESLFPGYNFRYAKYYKENGMEKRTLIKAF
GVRFDILVFGTGGKFDIIQLVVYIGSTLSYFGLATVCIDLIINTYASTCC
RSRVYPSCKCCEPCAVNEYYYRKKCEPIVEPKPTLKYVSFVDEPHIWMVD
QQLLGKSLQDVKGQEVPRPQTDFLELSRLDSPDWCQCGNCLPSQLPENRR
ALEELCCRRKPGQCITTSELFSKIVLSREALQLLLLYQEPLLALEGEAIN
SKLRHCAYRSYATWRFVSQDMADFAILPSCCRWKIRKEFPKTQGQYSGFK
YPY
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain8tr5 Chain B Residue 703 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
[Spin on] [Spin off] [Reset]
[High quality] [Low quality]
[White background] [Black background]
PDB8tr5 High-affinity agonism at the P2X7 receptor is mediated by three residues outside the orthosteric pocket
Resolution2.53 Å
Binding residue
(original residue number in PDB)		C477 C479 C482
Binding residue
(residue number reindexed from 1)		C435 C437 C440
Annotation score4
External links
PDB RCSB:8tr5, PDBe:8tr5, PDBj:8tr5
PDBsum8tr5
PubMed39107314
UniProtQ64663|P2RX7_RAT P2X purinoceptor 7 (Gene Name=P2rx7)

[Back to BioLiP]