Target Binding Site Detail

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Target General Information
Ligand General Information
Drug Binding Sites of Target
References
Target General Information  Top
Target ID T36075 Target Info
Target Name Glucagon-like peptide 1 receptor (GLP1R)
Synonyms GLP-1R; GLP-1-R; GLP-1 receptor
Target Type Successful Target
Gene Name GLP1R
Biochemical Class GPCR secretin
UniProt ID
GLP1R_HUMAN
Ligand General Information  Top
Ligand Name Decyl 4-O-Alpha-D-Glucopyranosyl-1-Thio-Beta-D-Glucopyranoside Ligand Info
Canonical SMILES CCCCCCCCCCSC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O
InChI 1S/C22H42O10S/c1-2-3-4-5-6-7-8-9-10-33-22-19(29)17(27)20(14(12-24)31-22)32-21-18(28)16(26)15(25)13(11-23)30-21/h13-29H,2-12H2,1H3/t13-,14-,15-,16+,17-,18-,19-,20-,21-,22+/m1/s1
InChIKey YZNNXXWNKQOETJ-HYLFJBCQSA-N
PubChem Compound ID 10345813
Drug Binding Sites of Target  Top
PDB ID: 3IOL      Crystal structure of Glucagon-Like Peptide-1 in complex with the extracellular domain of the Glucagon-Like Peptide-1 Receptor
Method X-ray diffraction Resolution 2.10 Å Mutation No [1]
PDB Sequence
TVSLWETVQK
38
WREYRRQCQR
48
SLTEDPPPAT
58
DLFCNRTFDE
68
YACWPDGEPG
78

SFVNVSCPWY
88
LPWASSVPQG
98
HVYRFCTAEG
108
LWLQKDNSSL
118
PWRDLSECEE
128
Residue
Distance (Å)
PHE80
4.295
GLN97
4.731
HIS99
3.734
TYR101
3.427
Residue
Distance (Å)
TRP120
4.243
ASP122
3.300
GLU125
3.779
PDB ID: 3C5T      Crystal structure of the ligand-bound glucagon-like peptide-1 receptor extracellular domain
Method X-ray diffraction Resolution 2.10 Å Mutation No [2]
PDB Sequence
ATVSLWETVQ
37
KWREYRRQCQ
47
RSLTEDPPPA
57
TDLFCNRTFD
67
EYACWPDGEP
77

GSFVNVSCPW
87
YLPWASSVPQ
97
GHVYRFCTAE
107
GLWLQKDNSS
117
LPWRDLSECE
127

ESKR
Residue
Distance (Å)
PHE80
3.547
ASN82
3.451
GLN97
3.817
Residue
Distance (Å)
HIS99
3.425
TYR101
2.698
GLU125
4.463
PDB ID: 3C59      Crystal structure of the ligand-bound glucagon-like peptide-1 receptor extracellular domain
Method X-ray diffraction Resolution 2.30 Å Mutation Yes [2]
PDB Sequence
TVSLWETVQK
38
WREYRRQCQR
48
SLTEDPPPAT
58
DLFCNRTFDE
68
YACWPDGEPG
78

SFVNVSCPWY
88
LPWASSVPQG
98
HVYRFCTAEG
108
LWLQKDNSSL
118
PWRDLSECEE
128

SKR
Residue
Distance (Å)
PHE80
3.514
ASN82
3.292
HIS99
3.431
Residue
Distance (Å)
TYR101
2.761
GLU125
4.521
References  Top
REF 1 Crystal structure of glucagon-like peptide-1 in complex with the extracellular domain of the glucagon-like peptide-1 receptor. J Biol Chem. 2010 Jan 1;285(1):723-30.
REF 2 Crystal structure of the ligand-bound glucagon-like peptide-1 receptor extracellular domain. J Biol Chem. 2008 Apr 25;283(17):11340-7.

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