Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T27889 | Target Info | |||
| Target Name | Angiotensin-converting enzyme 2 (ACE2) | ||||
| Synonyms | Processed angiotensinconverting enzyme 2; Metalloprotease MPROT15; Angiotensinconverting enzyme homolog; Angiotensinconverting enzyme 2; ACErelated carboxypeptidase; ACEH; ACE2 | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | ACE2 | ||||
| Biochemical Class | Peptidase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | 2-(Acetylamino)-2-Deoxy-a-D-Glucopyranose | Ligand Info | |||
| Canonical SMILES | CC(=O)NC1C(C(C(OC1O)CO)O)O | ||||
| InChI | 1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-,8+/m1/s1 | ||||
| InChIKey | OVRNDRQMDRJTHS-PVFLNQBWSA-N | ||||
| PubChem Compound ID | 82313 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 3D0G Crystal structure of spike protein receptor-binding domain from the 2002-2003 SARS coronavirus human strain complexed with human-civet chimeric receptor ACE2 | ||||||
| Method | X-ray diffraction | Resolution | 2.80 Å | Mutation | No | [1] |
| PDB Sequence |
STTEELAKTF
28 LETFNYEAQE38 LSYQSSVASW48 NYNTNITEEN58 VQNMNNAGDK68 WSAFLKEQST 78 LAQMYPLQEI88 QNLTVKLQLQ98 ALQQNGSSVL108 SEDKSKRLNT118 ILNTMSTIYS 128 TGKVCNPDNP138 QECLLLEPGL148 NEIMANSLDY158 NERLWAWESW168 RSEVGKQLRP 178 LYEEYVVLKN188 EMARANHYED198 YGDYWRGDYE208 VNGVDGYDYS218 RGQLIEDVEH 228 TFEEIKPLYE238 HLHAYVRAKL248 MNAYPSYISP258 IGCLPAHLLG268 DMWGRFWTNL 278 YSLTVPFGQK288 PNIDVTDAMV298 DQAWDAQRIF308 KEAEKFFVSV318 GLPNMTQGFW 328 ENSMLTDPGN338 VQKAVCHPTA348 WDLGKGDFRI358 LMCTKVTMDD368 FLTAHHEMGH 378 IQYDMAYAAQ388 PFLLRNGANE398 GFHEAVGEIM408 SLSAATPKHL418 KSIGLLSPDF 428 QEDNETEINF438 LLKQALTIVG448 TLPFTYMLEK458 WRWMVFKGEI468 PKDQWMKKWW 478 EMKREIVGVV488 EPVPHDETYC498 DPASLFHVSN508 DYSFIRYYTR518 TLYQFQFQEA 528 LCQAAKHEGP538 LHKCDISNST548 EAGQKLFNML558 RLGKSEPWTL568 ALENVVGAKN 578 MNVRPLLNYF588 EPLFTWLKDQ598 NKNSFVGWST608 DWSPYAD
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| PDB ID: 3D0I Crystal structure of spike protein receptor-binding domain from the 2005-2006 SARS coronavirus civet strain complexed with human-civet chimeric receptor ACE2 | ||||||
| Method | X-ray diffraction | Resolution | 2.90 Å | Mutation | No | [1] |
| PDB Sequence |
STTEELAKTF
28 LETFNYEAQE38 LSYQSSVASW48 NYNTNITEEN58 VQNMNNAGDK68 WSAFLKEQST 78 LAQMYPLQEI88 QNLTVKLQLQ98 ALQQNGSSVL108 SEDKSKRLNT118 ILNTMSTIYS 128 TGKVCNPDNP138 QECLLLEPGL148 NEIMANSLDY158 NERLWAWESW168 RSEVGKQLRP 178 LYEEYVVLKN188 EMARANHYED198 YGDYWRGDYE208 VNGVDGYDYS218 RGQLIEDVEH 228 TFEEIKPLYE238 HLHAYVRAKL248 MNAYPSYISP258 IGCLPAHLLG268 DMWGRFWTNL 278 YSLTVPFGQK288 PNIDVTDAMV298 DQAWDAQRIF308 KEAEKFFVSV318 GLPNMTQGFW 328 ENSMLTDPGN338 VQKAVCHPTA348 WDLGKGDFRI358 LMCTKVTMDD368 FLTAHHEMGH 378 IQYDMAYAAQ388 PFLLRNGANE398 GFHEAVGEIM408 SLSAATPKHL418 KSIGLLSPDF 428 QEDNETEINF438 LLKQALTIVG448 TLPFTYMLEK458 WRWMVFKGEI468 PKDQWMKKWW 478 EMKREIVGVV488 EPVPHDETYC498 DPASLFHVSN508 DYSFIRYYTR518 TLYQFQFQEA 528 LCQAAKHEGP538 LHKCDISNST548 EAGQKLFNML558 RLGKSEPWTL568 ALENVVGAKN 578 MNVRPLLNYF588 EPLFTWLKDQ598 NKNSFVGWST608 DWSPYAD
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| PDB ID: 3D0H Crystal structure of spike protein receptor-binding domain from the 2002-2003 SARS coronavirus civet strain complexed with human-civet chimeric receptor ACE2 | ||||||
| Method | X-ray diffraction | Resolution | 3.10 Å | Mutation | No | [1] |
| PDB Sequence |
STTEELAKTF
28 LETFNYEAQE38 LSYQSSVASW48 NYNTNITEEN58 VQNMNNAGDK68 WSAFLKEQST 78 LAQMYPLQEI88 QNLTVKLQLQ98 ALQQNGSSVL108 SEDKSKRLNT118 ILNTMSTIYS 128 TGKVCNPDNP138 QECLLLEPGL148 NEIMANSLDY158 NERLWAWESW168 RSEVGKQLRP 178 LYEEYVVLKN188 EMARANHYED198 YGDYWRGDYE208 VNGVDGYDYS218 RGQLIEDVEH 228 TFEEIKPLYE238 HLHAYVRAKL248 MNAYPSYISP258 IGCLPAHLLG268 DMWGRFWTNL 278 YSLTVPFGQK288 PNIDVTDAMV298 DQAWDAQRIF308 KEAEKFFVSV318 GLPNMTQGFW 328 ENSMLTDPGN338 VQKAVCHPTA348 WDLGKGDFRI358 LMCTKVTMDD368 FLTAHHEMGH 378 IQYDMAYAAQ388 PFLLRNGANE398 GFHEAVGEIM408 SLSAATPKHL418 KSIGLLSPDF 428 QEDNETEINF438 LLKQALTIVG448 TLPFTYMLEK458 WRWMVFKGEI468 PKDQWMKKWW 478 EMKREIVGVV488 EPVPHDETYC498 DPASLFHVSN508 DYSFIRYYTR518 TLYQFQFQEA 528 LCQAAKHEGP538 LHKCDISNST548 EAGQKLFNML558 RLGKSEPWTL568 ALENVVGAKN 578 MNVRPLLNYF588 EPLFTWLKDQ598 NKNSFVGWST608 DWSPYAD
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Structural analysis of major species barriers between humans and palm civets for severe acute respiratory syndrome coronavirus infections. J Virol. 2008 Jul;82(14):6984-91. | ||||
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