6LKE
in meso full-length rat KMO in complex with an inhibitor identified via DNA-encoded chemical library screening
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Kynurenine 3-monooxygenase | polymer | 495 | 56419.2 | 2 | UniProt (O88867) Pfam (PF01494) In PDB | Rattus norvegicus (Rat) | Kynurenine 3-hydroxylase |
2 | A, B | FLAVIN-ADENINE DINUCLEOTIDE | non-polymer | 785.5 | 2 | Chemie (FAD) | |||
3 | A, B | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) | |||
4 | A, B | CHLORIDE ION | non-polymer | 35.5 | 2 | Chemie (CL) | |||
5 | A, B | 4-chloranyl-2-[[5-chloranyl-2-(5-methoxy-1,3-dihydroisoindol-2-yl)-1,3-thiazol-4-yl]carbonyl-methyl-amino]-5-fluoranyl-benzoic acid | non-polymer | 496.3 | 2 | Chemie (EGU) | |||
6 | water | water | 18.0 | 6 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 478 (UniProt: O88867)
PDB | External Database | Details |
---|---|---|
Gly -1 | - | expression tag |
Ser 0 | - | expression tag |
Glu 479 | - | expression tag |
Asn 480 | - | expression tag |
Leu 481 | - | expression tag |
Tyr 482 | - | expression tag |
Phe 483 | - | expression tag |
Gln 484 | - | expression tag |
Gly 485 | - | expression tag |
Asp 486 | - | expression tag |
Tyr 487 | - | expression tag |
Lys 488 | - | expression tag |
Asp 489 | - | expression tag |
Asp 490 | - | expression tag |
Asp 491 | - | expression tag |
Asp 492 | - | expression tag |
Lys 493 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 112838.5 | |
Non-Polymers* | Number of molecules | 8 |
Total formula weight | 2826.8 | |
All* | Total formula weight | 115665.3 |