Binding Site Information of Target
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T50973 | Target Info | |||
| Target Name | Kynurenine 3-hydroxylase (KMO) | ||||
| Synonyms | Kynurenine 3monooxygenase; Kynurenine 3-monooxygenase | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | KMO | ||||
| Biochemical Class | Paired donor oxygen oxidoreductase | ||||
| UniProt ID | |||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| Ligand Name: Flavin-Adenine Dinucleotide | Ligand Info | |||||
| Structure Description | Crystal Structure of Human KMO | PDB:5X68 | ||||
| Method | X-ray diffraction | Resolution | 2.10 Å | Mutation | No | [1] |
| PDB Sequence |
RKKVAVIGGG
17 LVGSLQACFL27 AKRNFQIDVY37 EAREDTRVAS53 INLALSHRGR63 QALKAVGLED 73 QIVSQGIPMR83 ARMIHSLSGK93 KSAIPYGTKS103 QYILSVSREN113 LNKDLLTAAE 123 KYPNVKMHFN133 HRLLCNPEEG144 MITVLGSDKV154 PKDVTCDLIV164 GCDGAYSTVR 174 SHLMKPRFDY185 SQQYIPHGYM195 ELTIPPKNGD205 YAMEPNYLHI215 WPRNTFMMIA 225 LPNMNKSFTC235 TLFMPFEEFE245 KLLTSNDVVD255 FFQKYFPDAI265 PLIGEKLLVQ 275 DFFLLPAQPM285 ISVCSSFHFS297 HCVLLGDAAH307 AIVPFFGQGM317 NAGFEDCLVF 327 DELMDKFSND337 LSLCLPVFSR347 LRIPDDSDLS360 MYNYIEMRA
|
|||||
|
|
ILE14
3.997
GLY15
3.502
GLY16
4.278
GLY17
3.577
LEU18
3.450
VAL19
2.866
GLY20
3.926
TYR37
3.429
GLU38
2.557
ALA39
3.349
ARG40
3.261
SER53
4.134
ASN55
4.658
LEU56
3.488
ALA57
2.761
ARG111
2.209
HIS134
3.579
ARG135
3.676
LEU136
2.961
|
|||||
| Ligand Name: N(6),N(6)-Dimethyl-L-lysine | Ligand Info | |||||
| Structure Description | Crystal Structure of Human KMO | PDB:5X68 | ||||
| Method | X-ray diffraction | Resolution | 2.10 Å | Mutation | No | [1] |
| PDB Sequence |
RKKVAVIGGG
17 LVGSLQACFL27 AKRNFQIDVY37 EAREDTRVAS53 INLALSHRGR63 QALKAVGLED 73 QIVSQGIPMR83 ARMIHSLSGK93 KSAIPYGTKS103 QYILSVSREN113 LNKDLLTAAE 123 KYPNVKMHFN133 HRLLCNPEEG144 MITVLGSDKV154 PKDVTCDLIV164 GCDGAYSTVR 174 SHLMKPRFDY185 SQQYIPHGYM195 ELTIPPKNGD205 YAMEPNYLHI215 WPRNTFMMIA 225 LPNMNKSFTC235 TLFMPFEEFE245 KLLTSNDVVD255 FFQKYFPDAI265 PLIGEKLLVQ 275 DFFLLPAQPM285 ISVCSSFHFS297 HCVLLGDAAH307 AIVPFFGQGM317 NAGFEDCLVF 327 DELMDKFSND337 LSLCLPVFSR347 LRIPDDSDLS360 MYNYIEMRA
|
|||||
|
|
LEU136
3.185
LEU137
1.330
CYS139
1.329
ASN140
4.708
GLU142
2.703
MET145
4.958
ILE146
3.575
THR147
2.578
VAL148
4.965
THR172
4.647
HIS176
3.593
LEU177
3.925
MET178
1.330
LYS180
1.330
PRO181
3.882
SER287
4.549
|
|||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structural Basis for Inhibitor-Induced Hydrogen Peroxide Production by Kynurenine 3-Monooxygenase. Cell Chem Biol. 2018 Apr 19;25(4):426-438.e4. | ||||
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