7U0S
Crystal Structure of FK506-binding protein 1A from Aspergillus fumigatus Bound to Ascomycin
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | FK506-binding protein 1A | polymer | 154 | 16768.5 | 2 | UniProt (Q4WLV6) Pfam (PF00254) In PDB | Neosartorya fumigata (strain ATCC MYA-4609 / Af293 / CBS 101355 / FGSC A1100) | FKBP,Peptidyl-prolyl cis-trans isomerase,PPIase,Rapamycin-binding protein |
| 2 | A, B | (3S,4R,5S,8R,9E,12S,14S,15R,16S,18R,19R,22R,26aS)-8-ethyl-5,19-dihydroxy-3-{(1E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl}-14,16-dimethoxy-4,10,12,18-tetramethyl-5,6,8,11,12,13,14,15,16,17,18,19,24,25,26,26a-hexadecahydro-3H-15,19-epoxypyrido[2,1-c][1,4]oxazacyclotricosine-1,7,20,21(4H,23H)-tetrone | non-polymer | 792.0 | 2 | Chemie (KXX) | |||
| 3 | A, B | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) | |||
| 4 | A, B | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 3 | Chemie (PG4) | |||
| 5 | A | HEXAETHYLENE GLYCOL | non-polymer | 282.3 | 1 | Chemie (P6G) | |||
| 6 | A | ACETATE ION | non-polymer | 59.0 | 1 | Chemie (ACT) | |||
| 7 | A | PENTAETHYLENE GLYCOL | non-polymer | 238.3 | 1 | Chemie (1PE) | |||
| 8 | water | water | 18.0 | 221 | Chemie (HOH) |
Sequence modifications
A, B: 31 - 141 (UniProt: Q4WLV6)
| PDB | External Database | Details |
|---|---|---|
| Met -12 | - | initiating methionine |
| Ser -11 | - | expression tag |
| Gly -10 | - | expression tag |
| Ser -9 | - | expression tag |
| 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 |
| Gly 0 | - | expression tag |
| Gly 1 | - | expression tag |
| Glu 2 | - | expression tag |
| Asn 3 | - | expression tag |
| Leu 4 | - | expression tag |
| Tyr 5 | - | expression tag |
| Phe 6 | - | expression tag |
| Gln 7 | - | expression tag |
| Gly 8 | - | expression tag |
| Ser 9 | - | expression tag |
| Gly 10 | - | expression tag |
| Leu 11 | - | expression tag |
| Asn 12 | - | expression tag |
| Asp 13 | - | expression tag |
| Ile 14 | - | expression tag |
| Phe 15 | - | expression tag |
| Glu 16 | - | expression tag |
| Ala 17 | - | expression tag |
| Gln 18 | - | expression tag |
| Lys 19 | - | expression tag |
| Ile 20 | - | expression tag |
| Glu 21 | - | expression tag |
| Trp 22 | - | expression tag |
| His 23 | - | expression tag |
| Glu 24 | - | expression tag |
| Gly 25 | - | expression tag |
| Ser 26 | - | expression tag |
| Ser 27 | - | expression tag |
| Gly 28 | - | expression tag |
| Ser 29 | - | expression tag |
| Ser 30 | - | expression tag |
| Gly 119 | Pro 90 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 33537.0 | |
| Non-Polymers* | Number of molecules | 10 |
| Total formula weight | 2938.5 | |
| All* | Total formula weight | 36475.5 |
