7OCS
Mannitol-1-phosphate bound to the phosphatase domain of the bifunctional mannitol-1-phosphate dehydrogenase/phosphatase MtlD-D16A from Acinetobacter baumannii
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 (A, B, C, D) | HAD hydrolase, family IA, variant 3 | polymer | 727 | 83504.3 | 4 | UniProt (D0C7J2) Pfam (PF13419) Pfam (PF08125) | Acinetobacter baumannii ATCC 19606 = CIP 70.34 = JCM 6841 | |
| 2 | E, MA (A, C) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 3 | AA, F, G, H, I... (B, A, D) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 13 | Chemie (EDO) | |||
| 4 | K, L (A) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 2 | Chemie (PGE) | |||
| 5 | LA, M (C, A) | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 2 | Chemie (PG4) | |||
| 6 | N, YA (A, D) | BETA-MERCAPTOETHANOL | non-polymer | 78.1 | 2 | Chemie (BME) | |||
| 7 | AB, CA, DA, EA, O... (D, B, A, C) | SULFATE ION | non-polymer | 96.1 | 10 | Chemie (SO4) | |||
| 8 | S (A) | MAGNESIUM ION | non-polymer | 24.3 | 1 | Chemie (MG) | |||
| 9 | FA, GA, HA, IA, PA... (B, C, A) | CHLORIDE ION | non-polymer | 35.5 | 10 | Chemie (CL) | |||
| 10 | BB, KA, TA, W (D, B, C, A) | D-Mannitol-1-phosphate | non-polymer | 262.2 | 4 | Chemie (44H) | |||
| 11 | BA (B) | 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID | non-polymer | 238.3 | 1 | Chemie (EPE) | |||
| 12 | JA, SA (B, C) | SODIUM ION | non-polymer | 23.0 | 2 | Chemie (NA) | |||
| 13 | NA (C) | ACETATE ION | non-polymer | 59.0 | 1 | Chemie (ACT) | |||
| 14 | CB, DB, EB, FB (A, B, C, D) | water | water | 18.0 | 572 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 3 - 716 (UniProt: D0C7J2)
| PDB | External Database | Details |
|---|---|---|
| Met 1 | - | initiating methionine |
| Val 2 | - | expression tag |
| Ala 16 | Asp 15 | engineered mutation |
| Ala 717 | - | expression tag |
| Ala 718 | - | expression tag |
| Ala 719 | - | expression tag |
| Leu 720 | - | expression tag |
| Glu 721 | - | expression tag |
| His 722 | - | expression tag |
| His 723 | - | expression tag |
| His 724 | - | expression tag |
| His 725 | - | expression tag |
| His 726 | - | expression tag |
| His 727 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 334017.0 | |
| Non-Polymers* | Number of molecules | 50 |
| Total formula weight | 4567.5 | |
| All* | Total formula weight | 338584.5 |
