4DV8
Anthrax Lethal Factor metalloproteinase in complex with the Hydroxamic acid based small molecule PT8421
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Lethal factor | polymer | 526 | 61391.1 | 1 | UniProt (P15917) Pfam (PF09156) Pfam (PF07737) | Bacillus anthracis (anthrax anthrax bacterium) | LF, Anthrax lethal toxin endopeptidase component |
| 2 | B (A) | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 3 | C (A) | (2S)-6-[(4-fluorobenzyl)amino]-2-[(2R)-2-(4-fluorophenyl)-2-methoxyethyl]-N-hydroxyhexanamide | non-polymer | 406.5 | 1 | Chemie (0LX) | |||
| 4 | D (A) | MALONATE ION | non-polymer | 102.0 | 1 | Chemie (MLI) | |||
| 5 | E (A) | water | water | 18.0 | 706 | Chemie (HOH) |
Sequence modifications
A: 263 - 776 (UniProt: P15917)
| PDB | External Database | Details |
|---|---|---|
| Met 251 | - | expression tag |
| Arg 252 | - | expression tag |
| Gly 253 | - | expression tag |
| Ser 254 | - | expression tag |
| His 255 | - | expression tag |
| His 256 | - | expression tag |
| His 257 | - | expression tag |
| His 258 | - | expression tag |
| His 259 | - | expression tag |
| His 260 | - | expression tag |
| Gly 261 | - | expression tag |
| Ser 262 | - | expression tag |
| Ser 266 | Ala 299 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 61391.1 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 573.9 | |
| All* | Total formula weight | 61965.0 |
