2WID
NONAGED FORM OF HUMAN BUTYRYLCHOLINESTERASE INHIBITED BY TABUN ANALOGUE TA1
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | CHOLINESTERASE | polymer | 529 | 59713.5 | 1 | UniProt (P06276) Pfam (PF00135) | HOMO SAPIENS (HUMAN) | BUTYRYLCHOLINESTERASE, ACYLCHOLINE ACYLHYDROLASE, CHOLINE ESTERASE II, PSEUDOCHOLINESTERASE |
| 2 | B, D (B, D) | 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[beta-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 570.5 | 2 | In PDB GlyTouCan (G28454KX) | |||
| 3 | C (C) | beta-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose | branched | 367.3 | 1 | In PDB GlyTouCan (G61843VN) | |||
| 4 | E (A) | ETHYL HYDROGEN DIETHYLAMIDOPHOSPHATE | non-polymer | 181.2 | 1 | Chemie (TUN) | |||
| 5 | F (A) | SODIUM ION | non-polymer | 23.0 | 1 | Chemie (NA) | |||
| 6 | G, I, J, P, Q (A) | CHLORIDE ION | non-polymer | 35.5 | 5 | Chemie (CL) | |||
| 7 | H, K, L (A) | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
| 8 | M, N, O (A) | 2-acetamido-2-deoxy-beta-D-glucopyranose | non-polymer | 221.2 | 3 | Chemie (NAG) | |||
| 9 | R (A) | water | water | 18.0 | 336 | Chemie (HOH) |
Sequence modifications
A: 1 - 529 (UniProt: P06276)
| PDB | External Database | Details |
|---|---|---|
| Gln 17 | Asn 45 | engineered mutation |
| Thr 53 | Ser 81 | conflict |
| Gln 455 | Asn 483 | engineered mutation |
| Gln 481 | Asn 509 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 59713.5 | |
| Branched | Number of molecules | 3 |
| Total formula weight | 1508.4 | |
| Non-Polymers* | Number of molecules | 13 |
| Total formula weight | 1333.2 | |
| All* | Total formula weight | 62555.2 |
