4POP
ThiT with LMG139 bound
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) | Thiamine transporter ThiT | polymer | 192 | 21231.5 | 2 | UniProt (A2RI47) | Lactococcus lactis subsp. cremoris | Thiamine ECF transporter S component ThiT |
| 2 | AA, C (B, A) | 4-[(4-amino-2-methylpyrimidin-5-yl)methyl]-3-methylthiophene-2-carbaldehyde | non-polymer | 247.3 | 2 | Chemie (2VY) PubChem (91937245) | |||
| 3 | BA, D, E (B, A) | 2-(2-METHOXYETHOXY)ETHANOL | non-polymer | 120.1 | 3 | Chemie (PG0) PubChem (8134) | |||
| 4 | CA, DA, F, G, H (B, A) | nonyl beta-D-glucopyranoside | non-polymer | 306.4 | 5 | Chemie (BNG) PubChem (113558) PubChem (155448) PubChem (57484544) PubChem (67410050) PubChem (67410054) PubChem (67410579) PubChem (67410580) PubChem (67410693) PubChem (67411265) PubChem (67411760) PubChem (67412070) PubChem (67412159) PubChem (67412975) PubChem (67413017) PubChem (71245600) PubChem (92471074) PubChem (92471075) PubChem (94290254) PubChem (94290256) PubChem (95566082) PubChem (95566083) PubChem (101527253) PubChem (9818005) PubChem (11415532) PubChem (12986435) PubChem (14656373) PubChem (129854788) PubChem (131676744) PubChem (136212546) | |||
| 5 | EA, FA, GA, HA, I... (B, A) | DI(HYDROXYETHYL)ETHER | non-polymer | 106.1 | 21 | Chemie (PEG) PubChem (8117) | |||
| 6 | PA, QA, RA, S, SA... (B, A) | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 9 | Chemie (PG4) PubChem (8200) | |||
| 7 | UA, W, X (B, A) | PENTAETHYLENE GLYCOL | non-polymer | 238.3 | 3 | Chemie (1PE) PubChem (62551) | |||
| 8 | Y (A) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 1 | Chemie (PGE) | |||
| 9 | Z (A) | HEXAETHYLENE GLYCOL | non-polymer | 282.3 | 1 | Chemie (P6G) PubChem (17472) | |||
| 10 | VA (B) | 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL | non-polymer | 326.4 | 1 | Chemie (P33) PubChem (79718) | |||
| 11 | WA, XA (A, B) | water | water | 18.0 | 88 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 182 (UniProt: A2RI47)
| PDB | External Database | Details |
|---|---|---|
| Met -9 | - | initiating methionine |
| His -8 | - | expression tag |
| His -7 | - | expression tag |
| His -6 | - | expression tag |
| His -5 | - | expression tag |
| His -4 | - | expression tag |
| His -3 | - | expression tag |
| His -2 | - | expression tag |
| His -1 | - | expression tag |
| Ala 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 42463.0 | |
| Non-Polymers* | Number of molecules | 46 |
| Total formula weight | 7837.3 | |
| All* | Total formula weight | 50300.3 |
