2026-02-14_00000574
|
ligand
|
9Z0C
SARS-CoV-2 Papain-like Protease (PLpro) in complex with Fragment 7;
X-ray diffraction 1.90Å
Protein #1
326 residues (91% resolved)
Raw Sequence ...
MREVRTIKVFTTVDNINLHTQVVDMSMTYGQQFGPTYLDGADVTKIKPHNSHEGKTFYVLPNDDTLRVEAFEYYHTTDPSFLGRYMSALNHTKKWKYPQVNGLTSIKWADNNSYLATALLTLQQIELKFNPPALQDAYYRARAGEAANFCALILAYCNKTVGELGDVRETMSYLFQHANLDSCKRVLNVVCKTCGQQQTTLKGVEAVMYMGTLSYEQFKKGVQIPCTCGKQATKYLVQQESPFVMMSAPPAQYELKHGTFTCASEYTGNYQSGHYKHITSKETLYCIDGALLTKSSEYKGPITDVFYKENSYTTTIKPLEHHHHHH
Canonical Sequence ...
MREVRTIKVFTTVDNINLHTQVVDMSMTYGQQFGPTYLDGADVTKIKPHNSHEGKTFYVLPNDDTLRVEAFEYYHTTDPSFLGRYMSALNHTKKWKYPQVNGLTSIKWADNNSYLATALLTLQQIELKFNPPALQDAYYRARAGEAANFCALILAYCNKTVGELGDVRETMSYLFQHANLDSCKRVLNVVCKTCGQQQTTLKGVEAVMYMGTLSYEQFKKGVQIPCTCGKQATKYLVQQESPFVMMSAPPAQYELKHGTFTCASEYTGNYQSGHYKHITSKETLYCIDGALLTKSSEYKGPITDVFYKENSYTTTIKPLEHHHHHH
Non polymer #2
A1CZV
InChI=1S/C21H24N2O2/c1-14-12-16(6-9-22-14)17-4-5-18-19(24)13-21(25-20(18)15(17)2)7-10-23(3)11-8-21/h4-6,9,12H,7-8,10-11,13H2,1-3H3
InChI=1S/C21H24N2O2/c1-14-12-16(6-9-22-14)17-4-5-18-19(24)13-21(25-20(18)15(17)2)7-10-23(3)11-8-21/h4-6,9,12H,7-8,10-11,13H2,1-3H3
SMILES: Cc1cc(ccn1)c2ccc3c(c2C)OC4(CCN(CC4)C)CC3=O
Cc1cc(ccn1)c2ccc3c(c2C)OC4(CCN(CC4)C)CC3=O
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #4
NA
InChI=1S/Na/q+1
InChI=1S/Na/q+1
SMILES: [Na+]
[Na+]
Biounit #1
monomer
Download coordinates
Tube
Model
Reference
100%