3QHD
Crystal structure of 2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE Synthase from BURKHOLDERIA PSEUDOMALLEI bound to CYTIDINE, FOL795 and FOL955
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 (A, B, C) | 2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase | polymer | 183 | 19487.1 | 3 | UniProt (Q3JRA0) | Burkholderia pseudomallei | MECDP-synthase, MECPS |
| 2 | D, J, L (A, B, C) | ZINC ION | non-polymer | 65.4 | 3 | Chemie (ZN) | |||
| 3 | E (A) | CHLORIDE ION | non-polymer | 35.5 | 1 | Chemie (CL) PubChem (312) | |||
| 4 | F, K, M (A, B, C) | 4-AMINO-1-BETA-D-RIBOFURANOSYL-2(1H)-PYRIMIDINONE | non-polymer | 243.2 | 3 | Chemie (CTN) PubChem (16760387) PubChem (24729357) PubChem (25085165) PubChem (54353063) PubChem (44264135) PubChem (58899188) PubChem (44307610) PubChem (44356841) PubChem (45109772) PubChem (596) PubChem (70994952) PubChem (6480064) PubChem (57764456) PubChem (57807005) PubChem (58460874) PubChem (58519508) PubChem (71230474) PubChem (59476533) PubChem (59713247) PubChem (60138999) PubChem (66800112) PubChem (68199635) PubChem (89495334) PubChem (90089493) PubChem (117732781) PubChem (122468509) PubChem (6175) PubChem (6253) PubChem (114682) PubChem (122948) PubChem (160696) PubChem (3013211) PubChem (453552) PubChem (638040) PubChem (1265901) PubChem (5702244) PubChem (6476646) PubChem (6479885) PubChem (6551012) PubChem (6603781) PubChem (6713582) PubChem (12358851) PubChem (142117909) PubChem (148710634) PubChem (168266058) PubChem (171699434) | |||
| 5 | G (A) | 4-(1H-IMIDAZOL-1-YL)PHENOL | non-polymer | 160.2 | 1 | Chemie (MSR) PubChem (82315) | |||
| 6 | H (A) | 2-(pyridin-3-yl)-1,3-thiazole-4-carbaldehyde | non-polymer | 190.2 | 1 | Chemie (795) PubChem (18913501) | |||
| 7 | I (B) | POTASSIUM ION | non-polymer | 39.1 | 1 | Chemie (K) PubChem (813) | |||
| 8 | N, O, P (A, B, C) | water | water | 18.0 | 383 | Chemie (HOH) |
Sequence modifications
A, B, C: 1 - 162 (UniProt: Q3JRA0)
| PDB | External Database | Details |
|---|---|---|
| Met -20 | - | expression tag |
| Ala -19 | - | expression tag |
| His -18 | - | expression tag |
| His -17 | - | expression tag |
| His -16 | - | expression tag |
| His -15 | - | expression tag |
| His -14 | - | expression tag |
| His -13 | - | expression tag |
| Met -12 | - | expression tag |
| Gly -11 | - | expression tag |
| Thr -10 | - | expression tag |
| Leu -9 | - | expression tag |
| Glu -8 | - | expression tag |
| Ala -7 | - | expression tag |
| Gln -6 | - | expression tag |
| Thr -5 | - | expression tag |
| Gln -4 | - | expression tag |
| Gly -3 | - | expression tag |
| Pro -2 | - | expression tag |
| Gly -1 | - | expression tag |
| Ser 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 58461.3 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 1350.8 | |
| All* | Total formula weight | 59812.2 |
