7BDW
Crystal structure of mycobacterial PptAb in complex with ACP and compound 8918
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Possible 4'-phosphopantetheinyl transferase | polymer | 232 | 25432.1 | 1 | UniProt (B1MD73) Pfam (PF17837) Pfam (PF01648) In PDB | Mycobacterium tuberculosis | |
| 2 | B | Phthiocerol synthesis polyketide synthase type I PpsC | polymer | 157 | 16791.7 | 1 | UniProt (A0A2I7WB16) Pfam (PF00550) UniProt (by SIFTS) (P96202) In PDB | Mycobacterium tuberculosis | |
| 3 | A | COENZYME A | non-polymer | 767.5 | 1 | Chemie (COA) | |||
| 4 | A | N-(2,6-diethylphenyl)-N'-(N-ethylcarbamimidoyl)urea | non-polymer | 262.4 | 1 | Chemie (FD7) | |||
| 5 | A | MANGANESE (II) ION | non-polymer | 54.9 | 2 | Chemie (MN) | |||
| 6 | water | water | 18.0 | 8 | Chemie (HOH) |
Sequence modifications
A: 1 - 219 (UniProt: B1MD73)
B: 2060 - 2188 (UniProt: A0A2I7WB16)
| PDB | External Database | Details |
|---|---|---|
| Lys 220 | - | expression tag |
| Leu 221 | - | expression tag |
| Ala 222 | - | expression tag |
| Ala 223 | - | expression tag |
| Ala 224 | - | expression tag |
| Leu 225 | - | expression tag |
| Glu 226 | - | expression tag |
| His 227 | - | expression tag |
| His 228 | - | expression tag |
| His 229 | - | expression tag |
| His 230 | - | expression tag |
| His 231 | - | expression tag |
| His 232 | - | expression tag |
| PDB | External Database | Details |
|---|---|---|
| Met 2036 | - | initiating methionine |
| Gly 2037 | - | expression tag |
| Ser 2038 | - | expression tag |
| Ser 2039 | - | expression tag |
| His 2040 | - | expression tag |
| His 2041 | - | expression tag |
| His 2042 | - | expression tag |
| His 2043 | - | expression tag |
| His 2044 | - | expression tag |
| His 2045 | - | expression tag |
| Ser 2046 | - | expression tag |
| Ser 2047 | - | expression tag |
| Gly 2048 | - | expression tag |
| Leu 2049 | - | expression tag |
| Val 2050 | - | expression tag |
| Pro 2051 | - | expression tag |
| Arg 2052 | - | expression tag |
| Gly 2053 | - | expression tag |
| Ser 2054 | - | expression tag |
| His 2055 | - | expression tag |
| Met 2056 | - | expression tag |
| Ala 2057 | - | expression tag |
| Ile 2058 | - | expression tag |
| Arg 2059 | - | expression tag |
| Ala 2105 | Ser 112 | engineered mutation |
| Thr 2189 | - | expression tag |
| Ser 2190 | - | expression tag |
| Gly 2191 | - | expression tag |
| Ser 2192 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 42223.7 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1139.8 | |
| All* | Total formula weight | 43363.5 |
