4K3N
Phosphonic Arginine Mimetics as Inhibitors of the M17 Aminopeptidases from Plasmodium falciparum
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... | M17 leucyl aminopeptidase | polymer | 528 | 58709.0 | 12 | UniProt (Q8IL11) Pfam (PF00883) In PDB | Plasmodium falciparum 3D7 | |
2 | E, C, H, K, F... | ZINC ION | non-polymer | 65.4 | 24 | Chemie (ZN) | |||
3 | C, H, K, F, I... | CARBONATE ION | non-polymer | 60.0 | 12 | Chemie (CO3) | |||
4 | E, C, H, K, F... | {(R)-amino[4-(1H-pyrazol-1-yl)phenyl]methyl}phosphonic acid | non-polymer | 253.2 | 12 | Chemie (1OT) | |||
5 | B, E, C, H, K... | SULFATE ION | non-polymer | 96.1 | 21 | Chemie (SO4) | |||
6 | G, J, E, C, K... | PENTAETHYLENE GLYCOL | non-polymer | 238.3 | 34 | Chemie (1PE) | |||
7 | B, J, E, H, C... | NONAETHYLENE GLYCOL | non-polymer | 414.5 | 12 | Chemie (2PE) | |||
8 | water | water | 18.0 | 1784 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H, I, J, K, L: 84 - 605 (UniProt: Q8IL11)
PDB | External Database | Details |
---|---|---|
Gln 152 | Asn 152 | engineered mutation |
Gln 515 | Asn 515 | engineered mutation |
Gln 546 | Asn 546 | engineered mutation |
His 606 | - | expression tag |
His 607 | - | expression tag |
His 608 | - | expression tag |
His 609 | - | expression tag |
His 610 | - | expression tag |
His 611 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 12 |
Total formula weight | 704507.7 | |
Non-Polymers* | Number of molecules | 115 |
Total formula weight | 20420.9 | |
All* | Total formula weight | 724928.6 |