4BRF
Legionella pneumophila NTPDase1 crystal form II (closed) in complex with a distorted orthomolybdate ion and AMP
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | ECTONUCLEOSIDE TRIPHOSPHATE DIPHOSPHOHYDROLASE I | polymer | 368 | 41880.6 | 2 | UniProt (Q5ZUA2) Pfam (PF01150) | LEGIONELLA PNEUMOPHILA | NTPDASE1 |
| 2 | C, N (A, B) | MOLYBDATE ION | non-polymer | 159.9 | 2 | Chemie (MOO) PubChem (24621) | |||
| 3 | D, G, L, O, S... (A, B) | MAGNESIUM ION | non-polymer | 24.3 | 6 | Chemie (MG) PubChem (888) | |||
| 4 | E, P (A, B) | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 2 | Chemie (MES) PubChem (4478249) | |||
| 5 | F (A) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) PubChem (923) | |||
| 6 | H, R (A, B) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) PubChem (753) | |||
| 7 | I (A) | bis(mu2-oxo)-octaoxo-dimolybdenum (VI) | non-polymer | 351.9 | 1 | Chemie (M27) | |||
| 8 | J (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 1 | Chemie (EDO) | |||
| 9 | K, M (A, B) | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) PubChem (312) | |||
| 10 | Q (B) | ADENOSINE MONOPHOSPHATE | non-polymer | 347.2 | 1 | Chemie (AMP) PubChem (16397049) PubChem (16760266) PubChem (40459109) PubChem (46875232) PubChem (40467049) PubChem (40469468) PubChem (44348067) PubChem (45358029) PubChem (177678969) PubChem (6083) PubChem (46874558) PubChem (1549371) PubChem (92144436) PubChem (57358045) PubChem (12358354) PubChem (57879893) PubChem (57879902) PubChem (224) PubChem (122197642) PubChem (34768) PubChem (83862) PubChem (446048) PubChem (515384) PubChem (638042) PubChem (5316444) PubChem (5742864) PubChem (12163610) PubChem (12358355) PubChem (162290139) PubChem (162946266) PubChem (171699505) | |||
| 11 | U, V (A, B) | water | water | 18.0 | 547 | Chemie (HOH) |
Sequence modifications
A, B: 35 - 393 (UniProt: Q5ZUA2)
| PDB | External Database | Details |
|---|---|---|
| Met 34 | - | expression tag |
| Leu 394 | - | expression tag |
| Glu 395 | - | expression tag |
| His 396 | - | expression tag |
| His 397 | - | expression tag |
| His 398 | - | expression tag |
| His 399 | - | expression tag |
| His 400 | - | expression tag |
| His 401 | - | expression tag |
| Asp 137 | Glu 137 | conflict |
| Val 149 | Ala 149 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 83761.2 | |
| Non-Polymers* | Number of molecules | 18 |
| Total formula weight | 1895.4 | |
| All* | Total formula weight | 85656.6 |
