8B6T
X-ray structure of the interface optimized haloalkane dehalogenase HaloTag7 fusion to the green fluorescent protein GFP (ChemoG5-TMR) labeled with a chloroalkane tetramethylrhodamine fluorophore substrate
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) | Green fluorescent protein,Haloalkane dehalogenase | polymer | 531 | 60177.3 | 2 | UniProt (P42212) UniProt (P0A3G3) Pfam (PF01353) Pfam (PF00561) | Rhodococcus sp. | |
| 2 | C, E (A, B) | [9-[2-carboxy-5-[2-[2-(6-chloranylhexoxy)ethoxy]ethylcarbamoyl]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethyl-azanium | non-polymer | 637.2 | 2 | Chemie (OEH) | |||
| 3 | D, F (A, B) | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
| 4 | G, H (A, B) | water | water | 18.0 | 308 | Chemie (HOH) |
Sequence modifications
A, B: 2 - 237 (UniProt: P42212)
A, B: 238 - 527 (UniProt: P0A3G3)
| PDB | External Database | Details |
|---|---|---|
| Gly 1 | - | expression tag |
| Leu 63 | Tyr 66 | conflict |
| Cro 64 | Gly 67 | conflict |
| Lys 205 | Ala 206 | conflict |
| Arg 224 | Thr 225 | conflict |
| Leu 230 | His 231 | conflict |
| PDB | External Database | Details |
|---|---|---|
| Val 281 | Leu 47 | conflict |
| Thr 292 | Ser 58 | conflict |
| Gly 312 | Asp 78 | conflict |
| Phe 321 | Tyr 87 | conflict |
| Met 322 | Leu 88 | conflict |
| Phe 362 | Cys 128 | conflict |
| Arg 377 | Glu 143 | conflict |
| Arg 381 | Glu 147 | conflict |
| Thr 389 | Ala 155 | conflict |
| Lys 394 | Glu 160 | conflict |
| Val 401 | Ala 167 | conflict |
| Thr 406 | Ala 172 | conflict |
| Met 409 | Lys 175 | conflict |
| Gly 410 | Cys 176 | conflict |
| Asn 429 | Lys 195 | conflict |
| Glu 458 | Ala 224 | conflict |
| Asp 461 | Asn 227 | conflict |
| Lys 491 | Glu 257 | conflict |
| Ala 498 | Thr 264 | conflict |
| Glu 505 | Leu 271 | conflict |
| Asn 506 | His 272 | conflict |
| Leu 507 | Tyr 273 | conflict |
| Ser 525 | Pro 291 | conflict |
| Thr 526 | Ala 292 | conflict |
| Glu 528 | - | expression tag |
| Ile 529 | - | expression tag |
| Ser 530 | - | expression tag |
| Gly 531 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 120354.6 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1345.3 | |
| All* | Total formula weight | 121699.9 |
