4UVU
Crystal structure of human tankyrase 2 in complex with 1-((4-(5- methyl-1-oxo-1,2-dihydroisoquinolin-3-yl)phenyl)methyl)pyrrolidin-1- ium
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | TANKYRASE-2 | polymer | 240 | 27299.8 | 2 | UniProt (Q9H2K2) Pfam (PF00644) In PDB | HOMO SAPIENS (HUMAN) | TANK2, ADP-RIBOSYLTRANSFERASE DIPHTHERIA TOXIN-LIKE 6, ARTD 6, POLY ADP-RIBOSE POLYMERASE 5B, TNKS-2, TRF1-INTERACTING ANKYRIN -RELATED ADP-RIBOSE POLYMERASE 2, TANKYRASE II, TANKYRASE-LIKE PROTEIN, TANKYRASE-RELATED PROTEIN |
2 | A, B | 5-methyl-3-[4-(pyrrolidin-1-ylmethyl)phenyl]isoquinolin-1(2H)-one | non-polymer | 318.4 | 2 | Chemie (U1T) | |||
3 | A, B | ZINC ION | non-polymer | 65.4 | 2 | Chemie (ZN) | |||
4 | A, B | SULFATE ION | non-polymer | 96.1 | 4 | Chemie (SO4) | |||
5 | A, B | GLYCEROL | non-polymer | 92.1 | 3 | Chemie (GOL) | |||
6 | water | water | 18.0 | 256 | Chemie (HOH) |
Sequence modifications
A, B: 946 - 1162 (UniProt: Q9H2K2)
PDB | External Database | Details |
---|---|---|
Met 923 | - | expression tag |
His 924 | - | expression tag |
His 925 | - | expression tag |
His 926 | - | expression tag |
His 927 | - | expression tag |
His 928 | - | expression tag |
His 929 | - | expression tag |
Ser 930 | - | expression tag |
Ser 931 | - | expression tag |
Gly 932 | - | expression tag |
Val 933 | - | expression tag |
Asp 934 | - | expression tag |
Leu 935 | - | expression tag |
Gly 936 | - | expression tag |
Thr 937 | - | expression tag |
Glu 938 | - | expression tag |
Asn 939 | - | expression tag |
Leu 940 | - | expression tag |
Tyr 941 | - | expression tag |
Phe 942 | - | expression tag |
Gln 943 | - | expression tag |
Ser 944 | - | expression tag |
Met 945 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 54599.5 | |
Non-Polymers* | Number of molecules | 11 |
Total formula weight | 1428.2 | |
All* | Total formula weight | 56027.7 |