6VNS
Crystal structure of TYK2 kinase with compound 13
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A (A) | Non-receptor tyrosine-protein kinase TYK2 | polymer | 318 | 36550.6 | 1 | UniProt (P29597) Pfam (PF07714) | Homo sapiens (Human) | |
2 | B (A) | (1R,2R)-2-cyano-N-[(1S,5R)-3-(5-fluoro-2-{[1-(2-hydroxyethyl)-1H-pyrazol-4-yl]amino}pyrimidin-4-yl)-3-azabicyclo[3.1.0]hexan-1-yl]cyclopropane-1-carboxamide | non-polymer | 412.4 | 1 | Chemie (R5D) | |||
3 | C (A) | water | water | 18.0 | 157 | Chemie (HOH) |
Sequence modifications
A: 888 - 1182 (UniProt: P29597)
PDB | External Database | Details |
---|---|---|
Met 865 | - | expression tag |
Ala 866 | - | expression tag |
His 867 | - | expression tag |
His 868 | - | expression tag |
His 869 | - | expression tag |
His 870 | - | expression tag |
His 871 | - | expression tag |
His 872 | - | expression tag |
His 873 | - | expression tag |
His 874 | - | expression tag |
His 875 | - | expression tag |
His 876 | - | expression tag |
Gly 877 | - | expression tag |
Ala 878 | - | expression tag |
Leu 879 | - | expression tag |
Glu 880 | - | expression tag |
Val 881 | - | expression tag |
Leu 882 | - | expression tag |
Phe 883 | - | expression tag |
Gln 884 | - | expression tag |
Gly 885 | - | expression tag |
Pro 886 | - | expression tag |
Gly 887 | - | expression tag |
Ala 936 | Cys 936 | engineered mutation |
Ala 969 | Gln 969 | engineered mutation |
Ala 971 | Glu 971 | engineered mutation |
Ala 972 | Lys 972 | engineered mutation |
Ser 1016 | Ala 1016 | conflict |
Ala 1142 | Cys 1142 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 36550.6 | |
Non-Polymers* | Number of molecules | 1 |
Total formula weight | 412.4 | |
All* | Total formula weight | 36963.0 |