Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T29083 | Target Info | |||
| Target Name | Proto-oncogene c-Fes (FES) | ||||
| Synonyms | p93c-fes; Tyrosine-protein kinase Fes/Fps; Proto-oncogene c-Fps; Feline sarcoma/Fujinami avian sarcoma oncogene homolog; FPS | ||||
| Target Type | Literature-reported Target | ||||
| Gene Name | FES | ||||
| Biochemical Class | Kinase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Staurosporine | Ligand Info | |||
| Canonical SMILES | CC12C(C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)NC)OC | ||||
| InChI | 1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | ||||
| InChIKey | HKSZLNNOFSGOKW-FYTWVXJKSA-N | ||||
| PubChem Compound ID | 44259 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 3CBL Crystal structure of human feline sarcoma viral oncogene homologue (v-FES) in complex with staurosporine and a consensus peptide | ||||||
| Method | X-ray diffraction | Resolution | 1.75 Å | Mutation | No | [1] |
| PDB Sequence |
SMIPEVQKPL
455 HEQLWYHGAI465 PRAEVAELLV475 HSGDFLVRES485 QQEYVLSVPR502 HFIINLYRLF 520 PSIPLLIDHL530 LSTQQPLVVL545 HRAVPKDKWV555 LNHEDLVLGE565 QIGRGNFGEV 575 FSGRLRADNT585 LVAVKSCRET595 LPPDLKAKFL605 QEARILKQYS615 HPNIVRLIGV 625 CTQKQPIYIV635 MELVQGGDFL645 TFLRTEGARL655 RVKTLLQMVG665 DAAAGMEYLE 675 SKCCIHRDLA685 ARNCLVTEKN695 VLKISDFGMS705 REEADGVYAA715 SGGLRQVPVK 725 WTAPEALNYG735 RYSSESDVWS745 FGILLWETFS755 LGASPYPNLS765 NQQTREFVEK 775 GGRLPCPELC785 PDAVFRLMEQ795 CWAYEPGQRP805 SFSTIYQELQ815 SIRKRH |
|||||
|
|
HIS456
3.504
TRP554
3.950
LEU556
4.863
GLU559
3.398
ASP560
4.021
ILE567
3.517
GLY568
3.415
ARG569
3.388
GLY570
4.309
VAL575
3.924
LEU580
3.845
ARG581
3.675
ASP583
3.260
THR585
2.738
ALA588
3.212
LYS590
3.840
GLU607
3.481
SER615
4.767
|
|||||
| PDB ID: 3BKB Crystal structure of human Feline Sarcoma Viral Oncogene Homologue (v-FES) | ||||||
| Method | X-ray diffraction | Resolution | 1.78 Å | Mutation | No | [1] |
| PDB Sequence |
PEVQKPLHEQ
458 LWYHGAIPRA468 EVAELLVHSG478 DFLVRESQGK488 QEYVLSVLWD498 GLPRHFIIQS 508 LDNLYRLEGE518 GFPSIPLLID528 HLLSTQQPLT538 KKSGVVLHRA548 VPKDKWVLNH 558 EDLVLGEQIG568 RGNFGEVFSG578 RLRADNTLVA588 VKSCRETLPP598 DLKAKFLQEA 608 RILKQYSHPN618 IVRLIGVCTQ628 KQPIYIVMEL638 VQGGDFLTFL648 RTEGARLRVK 658 TLLQMVGDAA668 AGMEYLESKC678 CIHRDLAARN688 CLVTEKNVLK698 ISDFGMSREE 708 ADGVYAASGG718 LRQVPVKWTA728 PEALNYGRYS738 SESDVWSFGI748 LLWETFSLGA 758 SPYPNLSNQQ768 TREFVEKGGR778 LPCPELCPDA788 VFRLMEQCWA798 YEPGQRPSFS 808 TIYQELQSIR818 KRH
|
|||||
|
|
ILE567
3.485
GLY568
3.247
ARG569
3.527
GLY570
3.767
VAL575
3.770
ALA588
3.235
LYS590
3.804
GLU607
3.281
VAL620
4.212
MET636
3.753
GLU637
2.904
|
|||||
| PDB ID: 3CD3 Crystal structure of phosphorylated human feline sarcoma viral oncogene homologue (v-FES) in complex with staurosporine and a consensus peptide | ||||||
| Method | X-ray diffraction | Resolution | 1.98 Å | Mutation | No | [1] |
| PDB Sequence |
SMIPEVQKPL
455 HEQLWYHGAI465 PRAEVAELLV475 HSGDFLVRES485 QEYVLSVPRH503 FIINLYRLFP 521 SIPLLIDHLL531 STQQPLSGVV544 LHRAVPKDKW554 VLNHEDLVLG564 EQIGRGNFGE 574 VFSGRLRADN584 TLVAVKSCRP598 DLKAKFLQEA608 RILKQYSHPN618 IVRLIGVCTQ 628 KQPIYIVMEL638 VQGGDFLTFL648 RTEGARLRVK658 TLLQMVGDAA668 AGMEYLESKC 678 CIHRDLAARN688 CLVTEKNVLK698 ISDFGMSREE708 ADGVAASGGL719 RQVPVKWTAP 729 EALNYGRYSS739 ESDVWSFGIL749 LWETFSLGAS759 PYPNLSNQQT769 REFVEKGGRL 779 PCPELCPDAV789 FRLMEQCWAY799 EPGQRPSFST809 IYQELQSIRK819 RH |
|||||
|
|
HIS456
3.393
TRP554
3.736
LEU556
4.615
GLU559
3.415
ASP560
4.117
ILE567
3.385
GLY568
3.407
ARG569
3.385
GLY570
4.666
VAL575
3.807
LEU580
3.940
ARG581
3.587
ASP583
3.187
THR585
2.813
ALA588
3.165
LYS590
3.970
GLU607
3.454
SER615
4.685
|
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structural coupling of SH2-kinase domains links Fes and Abl substrate recognition and kinase activation. Cell. 2008 Sep 5;134(5):793-803. | ||||
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