7GQU
Crystal Structure of Werner helicase fragment 517-945 in covalent complex with N-[(E,1S)-1-cyclopropyl-3-methylsulfonylprop-2-enyl]-2-(1,1-difluoroethyl)-4-phenoxypyrimidine-5-carboxamide
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Bifunctional 3'-5' exonuclease/ATP-dependent helicase WRN | polymer | 439 | 50064.7 | 1 | UniProt (Q14191) Pfam (PF00270) Pfam (PF00271) Pfam (PF16124) In PDB | Homo sapiens (human) | |
2 | A | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
3 | A | ADENOSINE-5'-DIPHOSPHATE | non-polymer | 427.2 | 1 | Chemie (ADP) | |||
4 | A | N-[(1S)-1-cyclopropyl-3-(methanesulfonyl)propyl]-2-(1,1-difluoroethyl)-4-phenoxypyrimidine-5-carboxamide | non-polymer | 439.5 | 1 | Chemie (X1L) | |||
5 | A | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
6 | A | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
7 | water | water | 18.0 | 203 | Chemie (HOH) |
Sequence modifications
A: 517 - 945 (UniProt: Q14191)
PDB | External Database | Details |
---|---|---|
Met 516 | - | initiating methionine |
Gly 946 | - | expression tag |
Gly 947 | - | expression tag |
Arg 948 | - | expression tag |
Leu 949 | - | expression tag |
Glu 950 | - | expression tag |
Val 951 | - | expression tag |
Leu 952 | - | expression tag |
Phe 953 | - | expression tag |
Gln 954 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 50064.7 | |
Non-Polymers* | Number of molecules | 5 |
Total formula weight | 1047.2 | |
All* | Total formula weight | 51111.9 |