Brand  (β version)

PDB ID: 5QIK

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Ligands
Code Name Style Show Link
GOL Glycerol PoSSuM
J2M N-{4-[3-(6-fluoropyridin-3-yl)-4-oxo-4,5,6,7-tetrahydro-1h-pyrrolo[3,2-C]pyridin-2-yl]pyridin-2-yl}acetamide PoSSuM
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Structure summary

Code : 5QIK   PDBj   RCSB PDB   PDBe
Header : TRANSFERASE/TRANSFERASE INHIBITOR
Title : TGF-BETA RECEPTOR TYPE 1 KINASE DOMAIN (T204D) IN COMPLEX WITH N-{4-[3-(6-fluoropyridin-3-yl)-4-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-C]pyridin-2-yl]pyridin-2-yl}acetamide
Release Data : 2018-10-31
Compound :
mol_id molecule chains synonym
1 TGF-beta receptor type-1 A TGFR-1,Activin A receptor type II-like protein kinase of 53kD,Activin receptor-like kinase 5,ALK5,Serine/threonine-protein kinase receptor R4,SKR4,TGF-beta type I receptor,Transforming growth factor-beta receptor type I,TbetaR-I
ec: 2.7.11.30
fragment: KINASE DOMAIN, UNP RESIDUES 200-503
mutation: T204D
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human SPODOPTERA FRUGIPERDA  (taxid:7108)
gene: TGFBR1, ALK5, SKR4
expression_system_common: Fall armyworm
expression_system_vector_type: baculovirus
expression_system_plasmid: PFASTBAC1
Authors : Sheriff, S.
Keywords : ALK5, SB431542, KINASE DOMAIN, TRANSFERASE-TRANSFERASE INHIBITOR COMPLEX, TRANSFERASE
Exp. method : X-RAY DIFFRACTION ( 1.5800 Å )
Citation :

Discovery of 4-Azaindole Inhibitors of TGF beta RI as Immuno-oncology Agents.

Zhang, Y.,Zhao, Y.,Tebben, A.J.  et al.
(2018)  ACS Med Chem Lett  9 : 1117 - 1122

PubMed: 30429955
DOI: 10.1021/acsmedchemlett.8b00357

Reaction

Chain : A
UniProt : P36897 (TGFR1_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
L-threonyl-[receptor-protein] + ATP = O-phospho-L-threonyl- [receptor-protein] + ADP + H(+) 2.7.11.30 -
-
L-seryl-[receptor-protein] + ATP = O-phospho-L-seryl- [receptor-protein] + ADP + H(+) 2.7.11.30 -
-
Cofactor: Evidence: Note:
Mn(2+) ECO:0000250
ECO:0000250
-