Structure of PDB 8tqb Chain B Binding Site BS02

Receptor Information
>8tqb Chain B (length=744) Species: 10116 (Rattus norvegicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RREIKIEGDLVLGGLFPINEKGTGTEECGRINEDRGIQRLEAMLFAIDEI
NKDNYLLPGVKLGVHILDTCSRDTYALEQSLEFVRASLTKLLIAGVIGGS
YSSVSIQVANLLRLFQIPQISYASTSAKLSDKSRYDYFARTVPPDFYQAK
AMAEILRFFNWTYVSTVASEGDYGETGIEAFEQEARLRNICIATAEKVGR
SNIRKSYDSVIRELLQKPNARVVVLFMRSDDSRELIAAANRVNASFTWVA
SDGWGAQESIVKGSEHVAYGAITLELASHPVRQFDRYFQSLNPYNNHRNP
WFRDFWEQKFQCSLQNKRNHRQVCDKHLAIDSSNYEQESKIMFVVNAVYA
MAHALHKMQRTLCPNTTKLCDAMKILDGKKLYKEYLLKINFTAPFNPNKG
ADSIVKFDTFGDGMGRYNVFNLQQTGGKYSYLKVGHWAETLSLDVDSIHW
SRNSVPTSQCSDPCAPNEMKNMQPGDVCCWICIPCEPYEYLVDEFTCMDC
GPGQWPTADLSGCYNLPEDYIKWEDAWAIGPVTIACLGFLCTCIVITVFI
SGRELCYILLFGVSLSYCMTFFFIAKPSPVICALRRLGLGTSFAICYSAL
LTKTKFISPSSQVFICLGLILVQIVMVILETPGTRRYTLPEKRETVILKC
NVKDSSMLISLTYDVVLVILCTVYAFKTEAKFIGFTMYTTCIIWLAFLPI
FYVTSSDYRVQTTTMCISVSLSGFVVLGCLFAPKVHIVLFQPQK
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 chain8tqb Chain B 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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PDB8tqb Structural basis of allosteric modulation of metabotropic glutamate receptor activation and desensitization.
Resolution3.3 Å
Binding residue
(original residue number in PDB)
S152 Y222 R277
Binding residue
(residue number reindexed from 1)
S103 Y173 R228
Annotation score4
External links
PDB RCSB:8tqb, PDBe:8tqb, PDBj:8tqb
PDBsum8tqb
PubMed37645747
UniProtP31422|GRM3_RAT Metabotropic glutamate receptor 3 (Gene Name=Grm3)

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