6R8R
Structure of the Wnt deacylase Notum in complex with isoquinoline 45
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Palmitoleoyl-protein carboxylesterase NOTUM | polymer | 383 | 43567.1 | 1 | UniProt (Q6P988) Pfam (PF03283) | Homo sapiens (Human) | hNOTUM |
| 2 | B (A) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 1 | Chemie (NAG) | |||
| 3 | C (A) | ~{N}-isoquinolin-6-yl-2-(2-methylphenoxy)ethanamide | non-polymer | 292.3 | 1 | Chemie (JV8) | |||
| 4 | D, E, F, G, H... (A) | SULFATE ION | non-polymer | 96.1 | 8 | Chemie (SO4) | |||
| 5 | L, M, N, O, P (A) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 5 | Chemie (DMS) | |||
| 6 | Q, R, S, T, U... (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 10 | Chemie (EDO) | |||
| 7 | AA (A) | water | water | 18.0 | 183 | Chemie (HOH) |
Sequence modifications
A: 81 - 451 (UniProt: Q6P988)
| PDB | External Database | Details |
|---|---|---|
| Glu 78 | - | expression tag |
| Thr 79 | - | expression tag |
| Gly 80 | - | expression tag |
| Ser 330 | Cys 330 | engineered mutation |
| Gly 452 | - | expression tag |
| Thr 453 | - | expression tag |
| Lys 454 | - | expression tag |
| His 455 | - | expression tag |
| His 456 | - | expression tag |
| His 457 | - | expression tag |
| His 458 | - | expression tag |
| His 459 | - | expression tag |
| His 460 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 43567.1 | |
| Non-Polymers* | Number of molecules | 25 |
| Total formula weight | 2293.4 | |
| All* | Total formula weight | 45860.5 |
