Structure of PDB 8tr2 Chain A Binding Site BS02

Receptor Information
>8tr2 Chain A (length=745) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RREIKIEGDLVLGGLFPINEKGTGTEECGRINEDRGIQRLEAMLFAIDEI
NKDNYLLPGVKLGVHILDTCSRDTYALEQSLEFVRASLTKVDPLLIAGVI
GGSYSSVSIQVANLLRLFQIPQISYASTSAKLSDKSRYDYFARTVPPDFY
QAKAMAEILRFFNWTYVSTVASEGDYGETGIEAFEQEARLRNICIATAEK
VGRSNIRKSYDSVIRELLQKPNARVVVLFMRSDDSRELIAAANRVNASFT
WVASDGWGAQESIVKGSEHVAYGAITLELASHPVRQFDRYFQSLNPYNNH
RNPWFRDFWEQKFQCSLNHRCDKHLAIDSSNYEQESKIMFVVNAVYAMAH
ALHKMQRTLCPNTTKLCDAMKILDGKKLYKEYLLKINFTAPFNPNKGADS
IVKFDTFGDGMGRYNVFNLQQTGKYSYLKVGHWAETLSLDVDSIHWSRNS
VPTSQCSDPNEMKNMDVCCWICIPCEPYEYLVDEFTCMDCGPGQWPTADL
SGCYNLPEDYIKWEDAWAIGPVTIACLGFLCTCIVITVFIKHNNTASGRE
LCYILLFGVSLSYCMTFIAKPSPVICALRRLGLGTSFAICYSALLTKTNC
IARIFKNGSSQVFICLGLILVQIVMVSVWLILETPGTRRYTLPEKRETVI
LKCNVKDSSMLISLTYDVVLVILCTVYAFKTRKCFNEAKFIGFTMYTTCI
IWLAFLPIFYVTSTTMCISVSLSGFVVLGCLFAPKVHIVLFQPQK
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain8tr2 Chain A Residue 1002 [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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PDB8tr2 Structural basis of allosteric modulation of metabotropic glutamate receptor activation and desensitization.
Resolution3.5 Å
Binding residue
(original residue number in PDB)
P46 T98 Y150 V153
Binding residue
(residue number reindexed from 1)
P17 T69 Y104 V107
Annotation score4
External links
PDB RCSB:8tr2, PDBe:8tr2, PDBj:8tr2
PDBsum8tr2
PubMed37645747
UniProtP31422|GRM3_RAT Metabotropic glutamate receptor 3 (Gene Name=Grm3)

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