4HYP
Pyrrolopyrimidine inhibitors of dna gyrase b and topoisomerase iv, part i: structure guided discovery and optimization of dual targeting agents with potent, broad-spectrum enzymatic activity.
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B, C, D | DNA gyrase subunit B | polymer | 215 | 23850.8 | 4 | UniProt (P0AES6) Pfam (PF02518) In PDB | Escherichia coli | |
2 | A, B, C, D | N-[7-(1H-imidazol-1-yl)-2-(pyridin-3-yl)[1,3]thiazolo[5,4-d]pyrimidin-5-yl]cyclopropanecarboxamide | non-polymer | 363.4 | 4 | Chemie (1A1) | |||
3 | A, B, C, D | MAGNESIUM ION | non-polymer | 24.3 | 4 | Chemie (MG) | |||
4 | water | water | 18.0 | 375 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 15 - 224 (UniProt: P0AES6)
PDB | External Database | Details |
---|---|---|
Met 14 | - | expression tag |
Leu 225 | - | expression tag |
Glu 226 | - | expression tag |
His 227 | - | expression tag |
His 228 | - | expression tag |
His 229 | - | expression tag |
His 230 | - | expression tag |
His 231 | - | expression tag |
His 232 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 4 |
Total formula weight | 95403.1 | |
Non-Polymers* | Number of molecules | 8 |
Total formula weight | 1550.8 | |
All* | Total formula weight | 96953.9 |