Binding Site Information of Target
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T14875 | Target Info | |||
| Target Name | Ubiquitin carboxyl-terminal hydrolase 14 (USP14) | ||||
| Synonyms | Ubiquitin-specific-processing protease 14; Ubiquitin thioesterase 14; TGT; Deubiquitinating enzyme 14 | ||||
| Target Type | Preclinical Target | ||||
| Gene Name | USP14 | ||||
| Biochemical Class | Peptidase | ||||
| UniProt ID | |||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| Ligand Name: IU1 | Ligand Info | |||||
| Structure Description | USP14 catalytic domain with IU1 | PDB:6IIK | ||||
| Method | X-ray diffraction | Resolution | 1.97 Å | Mutation | No | [1] |
| PDB Sequence |
ELPCGLTNLG
111 NTCYMNATVQ121 CIRSVPELKD131 ALKRYAGALR141 ASGEMASAQY151 ITAALRDLFD 161 SMDKTSSSIP171 PIILLQFLHM181 AFPQFAEKGE191 QGQYLQQDAN201 ECWIQMMRVL 211 QQKLEAIEDK240 SLIDQFFGVE250 FETTMKCTES260 EEEEVTKGKE270 NQLQLSCFIN 280 QEVKYLFTGL290 KLRLQEEITK300 QSPTLQRNAL310 YIKSSKISRL320 PAYLTIQMVR 330 FFNAKVLKDV347 KFPLMLDMYE357 LCTPELQEKM367 VSFRSKFKDL377 YEPFSFADDI 410 GSNNCGYYDL420 QAVLTHQGRS430 SSSGHYVSWV440 KRKQDEWIKF450 DDDKVSIVTP 460 EDILRLSGGG470 DWHIAYVLLY480 GPRRV
|
|||||
|
|
||||||
| Ligand Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(piperidin-1-yl)ethan-1-one | Ligand Info | |||||
| Structure Description | USP14 catalytic domain bind to IU1-47 | PDB:6IIL | ||||
| Method | X-ray diffraction | Resolution | 2.20 Å | Mutation | No | [1] |
| PDB Sequence |
ELPCGLTNLG
111 NTCYMNATVQ121 CIRSVPELKD131 ALKRYAGALR141 ASGEMASAQY151 ITAALRDLFD 161 SMDKTSSSIP171 PIILLQFLHM181 AFPQFAEKGE191 QGQYLQQDAN201 ECWIQMMRVL 211 QQKLEAIEDK240 SLIDQFFGVE250 FETTMKCTES260 EEEEVTKGKE270 NQLQLSCFIN 280 QEVKYLFTGL290 KLRLQEEITK300 QSPTLQRNAL310 YIKSSKISRL320 PAYLTIQMVR 330 FFNAKVLKDV347 KFPLMLDMYE357 LCTPELQEKM367 VSFRSKFKDL377 EDKKYEPFSF 406 ADDIGSNNCG416 YYDLQAVLTH426 QGRSSSSGHY436 VSWVKRKQDE446 WIKFDDDKVS 456 IVTPEDILRL466 SGGGDWHIAY476 VLLYGPRRVE486 I
|
|||||
|
|
||||||
| Ligand Name: 1-[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(4-hydroxypiperidin-1-yl)ethan-1-one | Ligand Info | |||||
| Structure Description | USP14 catalytic domain with IU1-206 | PDB:6IIM | ||||
| Method | X-ray diffraction | Resolution | 2.21 Å | Mutation | No | [1] |
| PDB Sequence |
ELPCGLTNLG
111 NTCYMNATVQ121 CIRSVPELKD131 ALKRYAGALR141 ASGEMASAQY151 ITAALRDLFD 161 SMDKTSSSIP171 PIILLQFLHM181 AFPQFAEKGE191 QGQYLQQDAN201 ECWIQMMRVL 211 QQKLEAIEDK240 SLIDQFFGVE250 FETTMKCTES260 EEEEVTKGKE270 NQLQLSCFIN 280 QEVKYLFTGL290 KLRLQEEITK300 QSPTLQRNAL310 YIKSSKISRL320 PAYLTIQMVR 330 FFYKEVNAKV343 LKDVKFPLML353 DMYELCTPEL363 QEKMVSFRSK373 FKDLEPFSFA 407 DDIGSNNCGY417 YDLQAVLTHQ427 GRSSSSGHYV437 SWVKRKQDEW447 IKFDDDKVSI 457 VTPEDILRLS467 GGGDWHIAYV477 LLYGPRRV
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .A8L or .A8L2 or .A8L3 or :3A8L;style chemicals stick;color identity;select .A:188 or .A:196 or .A:197 or .A:198 or .A:199 or .A:330 or .A:331 or .A:340 or .A:342 or .A:426 or .A:430 or .A:431 or .A:432 or .A:433 or .A:436 or .A:476; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| Ligand Name: 4-{3-[(4-hydroxypiperidin-1-yl)acetyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzonitrile | Ligand Info | |||||
| Structure Description | USP14 catalytic domain with IU1-248 | PDB:6IIN | ||||
| Method | X-ray diffraction | Resolution | 2.53 Å | Mutation | No | [1] |
| PDB Sequence |
MELPCGLTNL
110 GNTCYMNATV120 QCIRSVPELK130 DALKRYAGAL140 RASGEMASAQ150 YITAALRDLF 160 DSMDKTSSSI170 PPIILLQFLH180 MAFPQFAEKG190 EQGQYLQQDA200 NECWIQMMRV 210 LQQKLEAIEK240 SLIDQFFGVE250 FETTMKCTES260 EEEEVTKGKE270 NQLQLSCFIN 280 QEVKYLFTGL290 KLRLQEEITK300 QSPTLQRNAL310 YIKSSKISRL320 PAYLTIQMVR 330 FFYNAKVLKD346 VKFPLMLDMY356 ELCTPELQEK366 MVSFRSKFKD376 LYEPFSFADD 409 IGSNNCGYYD419 LQAVLTHQGR429 SSSSGHYVSW439 VKRKQDEWIK449 FDDDKVSIVT 459 PEDILRLSGG469 GDWHIAYVLL479 YGPRRV
|
|||||
|
Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .A8O or .A8O2 or .A8O3 or :3A8O;style chemicals stick;color identity;select .A:188 or .A:196 or .A:197 or .A:198 or .A:199 or .A:330 or .A:331 or .A:342 or .A:426 or .A:430 or .A:431 or .A:432 or .A:433 or .A:434 or .A:436 or .A:474 or .A:475 or .A:476; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
||||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Small molecule inhibitors reveal allosteric regulation of USP14 via steric blockade. Cell Res. 2018 Dec;28(12):1186-1194. | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.