Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T14558 | Target Info | |||
| Target Name | Tryptase alpha/beta-1 (Tryptase) | ||||
| Synonyms | Tryptase-1; Tryptase alpha-1; Tryptase I; TPSB1; TPS2; TPS1 | ||||
| Target Type | Successful Target | ||||
| Gene Name | TPSAB1 | ||||
| Biochemical Class | Peptidase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | amino{[(4S)-4-amino-5,5-dihydroxypentyl]amino}methaniminium | Ligand Info | |||
| Canonical SMILES | C(CC(C(O)O)N)C[NH+]=C(N)N | ||||
| InChI | 1S/C6H16N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4-5,11-12H,1-3,7H2,(H4,8,9,10)/p+1/t4-/m0/s1 | ||||
| InChIKey | GJQTZIGWTNAHJO-BYPYZUCNSA-O | ||||
| PubChem Compound ID | 137348943 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 2F9N Crystal Structure of the Recombinant Human Alpha I Tryptase Mutant K192Q/D216G in Complex with Leupeptin | ||||||
| Method | X-ray diffraction | Resolution | 1.60 Å | Mutation | Yes | [1] |
| PDB Sequence |
IVGGQEAPRS
25 KWPWQVSLRV35 RDRYWMHFCG43 GSLIHPQWVL53 TAAHCVGPDV60C KDLATLRVQL 68 REQHLYYQDQ81 LLPVSRIIVH91 PQFYIIQTGA101 DIALLELEEP111 VNISSRVHTV 121 MLPPASETFP131 PGMPCWVTGW141 GDVDNDEPLP152 PPFPLKQVKV160 PIMENHICDA 170 KYHLGAYTGD173G DVRIIRDDML181 CAGNSQRDSC191 QGDSGGPLVC201 KVNGTWLQAG 211 VVSWGEGCAQ221A PNRPGIYTRV231 TYYLDWIHHY241 VPK
|
|||||
|
|
CYS42
4.919
HIS57
2.810
ASP189
2.864
SER190
3.017
CYS191
3.535
GLN192
3.510
GLY193
4.320
ASP194
4.752
SER195
1.414
VAL213
3.802
SER214
2.958
|
|||||
| PDB ID: 2F9P Crystal Structure of the Recombinant Human Alpha I Tryptase Mutant D216G in Complex with Leupeptin | ||||||
| Method | X-ray diffraction | Resolution | 2.30 Å | Mutation | Yes | [1] |
| PDB Sequence |
IVGGQEAPRS
25 KWPWQVSLRV35 RDRYWMHFCG43 GSLIHPQWVL53 TAAHCVGPDV60C KDLATLRVQL 68 REQHLYYQDQ81 LLPVSRIIVH91 PQFYIIQTGA101 DIALLELEEP111 VNISSRVHTV 121 MLPPASETFP131 PGMPCWVTGW141 GDVDNDEPLP152 PPFPLKQVKV160 PIMENHICDA 170 KYHLGAYTGD173G DVRIIRDDML181 CAGNSQRDSC191 KGDSGGPLVC201 KVNGTWLQAG 211 VVSWGEGCAQ221A PNRPGIYTRV231 TYYLDWIHHY241 VPK
|
|||||
|
|
CYS42
4.982
HIS57
2.819
ASP189
2.919
SER190
3.151
CYS191
3.863
LYS192
4.094
GLY193
4.257
SER195
1.416
VAL213
3.851
SER214
3.025
TRP215
3.934
|
|||||
| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | X-ray structures of free and leupeptin-complexed human alphaI-tryptase mutants: indication for an alpha-->beta-tryptase transition. J Mol Biol. 2006 Mar 17;357(1):195-209. | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.