5G68
Structure of Bacillus subtilis Nitric Oxide Synthase in complex with 7-(2-(3-(3-Fluorophenyl(propylamino)methyl))quinolin-2- amine
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | NITRIC OXIDE SYNTHASE OXYGENASE | polymer | 363 | 41787.1 | 1 | UniProt (O34453) Pfam (PF02898) | BACILLUS SUBTILIS | NOSOXY-LIKE PROTEIN, NITRIC OXIDE SYNTHASE |
| 2 | B (A) | PROTOPORPHYRIN IX CONTAINING FE | non-polymer | 616.5 | 1 | Chemie (HEM) | |||
| 3 | C (A) | 5,6,7,8-TETRAHYDROBIOPTERIN | non-polymer | 241.2 | 1 | Chemie (H4B) | |||
| 4 | D (A) | CHLORIDE ION | non-polymer | 35.5 | 1 | Chemie (CL) | |||
| 5 | E, F (A) | 7-({[3-(3-fluorophenyl)propyl]amino}methyl)quinolin-2-amine | non-polymer | 309.4 | 2 | Chemie (ML6) | |||
| 6 | G (A) | 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL | non-polymer | 209.2 | 1 | Chemie (BTB) | |||
| 7 | H (A) | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
| 8 | I (A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 1 | Chemie (PEG) | |||
| 9 | J, K, L, M (A) | N-PROPANOL | non-polymer | 60.1 | 4 | Chemie (POL) | |||
| 10 | N (A) | water | water | 18.0 | 322 | Chemie (HOH) |
Sequence modifications
A: 1 - 363 (UniProt: O34453)
| PDB | External Database | Details |
|---|---|---|
| Ala 25 | Glu 25 | engineered mutation |
| Ala 26 | Glu 26 | engineered mutation |
| Ala 316 | Glu 316 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 41787.1 | |
| Non-Polymers* | Number of molecules | 12 |
| Total formula weight | 2159.8 | |
| All* | Total formula weight | 43946.9 |
