8AQ6
NanoLuc luciferase with bound furimamide in surface allosteric site
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, E... (A, B, C, D, E...) | NanoLuc luciferase | polymer | 181 | 20389.2 | 8 | UniProt (Q9GV45) | Oplophorus gracilirostris (Luminous shrimp) | 19kOLase,Oplophorus-luciferin 2-monooxygenase catalytic subunit |
| 2 | I, NA (A, H) | GLYCEROL | non-polymer | 92.1 | 2 | Chemie (GOL) | |||
| 3 | AA, BA, J, K, L... (E, A, B, C) | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 7 | Chemie (PG4) | |||
| 4 | M (A) | OXYGEN MOLECULE | non-polymer | 32.0 | 1 | Chemie (OXY) | |||
| 5 | CA, DA, EA, FA, GA... (E, F, G, A, H...) | CHLORIDE ION | non-polymer | 35.5 | 22 | Chemie (CL) | |||
| 6 | X (D) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 1 | Chemie (PGE) | |||
| 7 | IA (G) | N-(3-Benzyl-5-phenylpyrazin-2-yl)-2-(furan-2-yl)acetamide | non-polymer | 369.4 | 1 | Chemie (NT0) | |||
| 8 | QA, RA, SA, TA, UA... (A, B, C, D, E...) | water | water | 18.0 | 770 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H: 1 - 169 (UniProt: Q9GV45)
| PDB | External Database | Details |
|---|---|---|
| Met -11 | - | initiating methionine |
| His -10 | - | expression tag |
| His -9 | - | expression tag |
| His -8 | - | expression tag |
| His -7 | - | expression tag |
| His -6 | - | expression tag |
| His -5 | - | expression tag |
| Ser -4 | - | expression tag |
| Asp -3 | - | expression tag |
| Asn -2 | - | expression tag |
| Met -1 | - | expression tag |
| Val 0 | - | expression tag |
| Glu 4 | Ala 31 | engineered mutation |
| Arg 11 | Gln 38 | engineered mutation |
| Leu 18 | Gln 45 | engineered mutation |
| Val 27 | Leu 54 | engineered mutation |
| Asn 33 | Ala 60 | engineered mutation |
| Arg 43 | Lys 70 | engineered mutation |
| Ile 44 | Val 71 | engineered mutation |
| Ile 54 | Ala 81 | engineered mutation |
| Asp 68 | Phe 95 | engineered mutation |
| Gln 72 | Leu 99 | engineered mutation |
| Lys 75 | Met 102 | engineered mutation |
| Val 90 | Ile 117 | engineered mutation |
| Glu 115 | Pro 142 | engineered mutation |
| Lys 124 | Gln 151 | engineered mutation |
| Ile 138 | Tyr 165 | engineered mutation |
| Arg 166 | Asn 193 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 8 |
| Total formula weight | 163113.9 | |
| Non-Polymers* | Number of molecules | 34 |
| Total formula weight | 2875.3 | |
| All* | Total formula weight | 165989.2 |
