X-ray Structures

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    Title: SARS

Page 1 of 3, showing 20 records  out of 47 total, starting on record 1 structures.
Click on the title of a structure below to see more information about that structure.

Target IDP52003

Title: The crystal structure of Papain-Like Protease of SARS CoV-2, C111S mutant, in complex with PLP_Snyder441
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7KRX (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , 3-amino-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide
Other ligands: , , Unknown atom
R: 21.2%
Rfree: 24.9%
Resolution: 2.72Å
Deposited: 2020-11-20
Released:
Title: The crystal structure of Papain-Like Protease of SARS CoV-2, C111S mutant, in complex with PLP_Snyder494
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7KOJ (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , unknown
Other ligands: , , MES, Unknown atom
R: 18.4%
Rfree: 20.3%
Resolution: 2.02Å
Deposited: 2020-11-09
Released:
Title: The crystal structure of Papain-Like Protease of SARS CoV-2 in complex with PLP_Snyder496
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7KOL (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , unknown
Other ligands: , MES
R: 18.9%
Rfree: 20.6%
Resolution: 2.58Å
Deposited: 2020-11-09
Released:
Title: The crystal structure of Papain-Like Protease of SARS CoV-2, C111S mutant, in complex with PLP_Snyder496
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7KOK (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , unknown
Other ligands: , , MES, Unknown atom
R: 18.5%
Rfree: 21.1%
Resolution: 2Å
Deposited: 2020-11-09
Released:
Title: Crystal structure of the ubiquitin-like domain 1 (Ubl1) of Nsp3 from SARS-CoV-2
Authors: Stogios PJ, Skarina T, Chang C, Kim Y, Di Leo R, Savchenko A, Joachimiak A, Satchell KJF, Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7KAG (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: ,
R: 21.8%
Rfree: 24.8%
Resolution: 3.21Å
Deposited: 2020-09-30
Released: 2020-10-14

Target IDP52001

Title: Crystal Structure of NSP1 from SARS-CoV-2
Authors: Semper, C., Watanabe, N., Chang, C., Savchenko, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7K3N (PDBSUM) (Profunc) (GPSS) (MMDB)
R: 20.8%
Rfree: 24.8%
Resolution: 1.65Å
Deposited: 2020-09-11
Released:

Target CPX_52010_52016

Title: Crystal Structure of SARS-CoV-2 Nsp16/10 Heterodimer in Complex with (m7GpppA2m)pUpUpApApA (Cap-1) and S-Adenosyl-L-homocysteine (SAH).
Authors: Minasov, G., Shuvalova, L., Rosas-Lemus, M., Kiryukhina, O., Brunzelle, J.S., Satchell, K.J.F., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JZ0 (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , , 2'-o-methyl-adenosine-5'-monophosphate, 7n-methyl-8-hydroguanosine-5'-diphosphate, unknown, unknown
Other ligands: , ,
R: 17.5%
Rfree: 19.8%
Resolution: 2.15Å
Deposited: 2020-09-01
Released: 2020-09-16
Title: Crystal Structure of SARS-CoV-2 Nsp16/10 Heterodimer in Complex with (m7GpppA)pUpUpApApA (Cap-0) and S-Adenosylmethionine (SAM).
Authors: Minasov, G., Shuvalova, L., Rosas-Lemus, M., Kiryukhina, O., Brunzelle, J.S., Satchell, K.J.F., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JYY (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , , 7n-methyl-8-hydroguanosine-5'-diphosphate, s-adenosylmethionine, unknown, unknown
Other ligands: , ,
R: 16.7%
Rfree: 18.5%
Resolution: 2.05Å
Deposited: 2020-09-01
Released: 2020-09-16

Target IDP52005

Title: The crystal structure of SARS-CoV-2 Main Protease in complex with masitinib
Authors: K. Tan, N.I. Maltseva, L.F. Welk, R.P. Jedrzejczak, A. Joachimiak, Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JU7 (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with:
Other ligands: ,
R: 17%
Rfree: 19.1%
Resolution: 1.6Å
Deposited: 2020-08-19
Released:

Target IDP52003

Title: The crystal structure of Papain-Like Protease of SARS CoV-2 in complex with PLP_Snyder441
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JN2 (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , 3-amino-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide
Other ligands: , , Unknown atom
R: 18.7%
Rfree: 20.9%
Resolution: 1.93Å
Deposited: 2020-08-03
Released: 2020-08-12
Title: The crystal structure of Papain-Like Protease of SARS CoV-2 , C111S mutant, in complex with PLP_Snyder495
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JIT (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , 5-[(carbamoylcarbamoyl)amino]-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide
Other ligands: , , MES
R: 17.6%
Rfree: 19%
Resolution: 1.95Å
Deposited: 2020-07-23
Released: 2020-08-05
Title: The crystal structure of Papain-Like Protease of SARS CoV-2 in complex with PLP_Snyder530
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JIW (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , 5-(acryloylamino)-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide
Other ligands: , MES
R: 21.4%
Rfree: 24%
Resolution: 2.3Å
Deposited: 2020-07-23
Released: 2020-08-05
Title: The crystal structure of Papain-Like Protease of SARS CoV-2 , C111S mutant, in complex with PLP_Snyder530
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JIV (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , 5-(acryloylamino)-2-methyl-N-[(1R)-1-(naphthalen-1-yl)ethyl]benzamide
Other ligands: , , MES
R: 18.9%
Rfree: 20.1%
Resolution: 2.05Å
Deposited: 2020-07-23
Released: 2020-08-05
Title: The crystal structure of Papain-Like Protease of SARS CoV-2 , C111S mutant, in complex with PLP_Snyder457
Authors: Osipiuk, J., Tesar, C., Endres, M., Lisnyak, V., Maki, S., Taylor, C., Zhang, Y., Zhou, Z., Azizi, S.A., Jones, K., Kathayat, R., Snyder, S.A., Dickinson, B.C., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JIR (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: , 5-amino-2-methyl-n-[(1r)-1-naphthalen-1-ylethyl]benzami de
Other ligands: , , MES
R: 18.7%
Rfree: 20%
Resolution: 2.09Å
Deposited: 2020-07-23
Released: 2020-08-05

Target IDP52005

Title: The crystal structure of 3CL MainPro of SARS-CoV-2 with de-oxidized C145
Authors: K.Tan, N.I. Maltseva, L.F. Welk, R.P. Jedrzejczak, A. Joachimiak, Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 7JFQ (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: ,
R: 17.1%
Rfree: 19.8%
Resolution: 1.55Å
Deposited: 2020-07-17
Released:
Title: X-ray Structure of SARS-CoV-2 main protease bound to GRL-024-20 at 1.45 A
Authors: Anson, B.J. Ghosh, A.K. Mesecar, A.D. Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 6XR3 (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with: unknown
R: 14.5%
Rfree: 18.7%
Resolution: 1.45Å
Deposited: 2020-07-10
Released: 2020-08-19
Title: The crystal structure of 3CL MainPro of SARS-CoV-2 with C145S mutation
Authors: K.Tan, N.I. Maltseva, L.F. Welk, R.P. Jedrzejczak, A. Joachimiak, Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 6XOA (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: ,
R: 20.8%
Rfree: 25.1%
Resolution: 2.1Å
Deposited: 2020-07-06
Released:
Title: THE 1.28A CRYSTAL STRUCTURE OF 3CL MAINPRO OF SARS-COV-2 WITH OXIDIZED C145 (sulfinic acid cysteine)
Authors: K.Tan, N.I. Maltseva, L.F. Welk, R.P. Jedrzejczak, L. Coates, A.Y. Kovalevskyi, A. Joachimiak, Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 6XKH (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: , ,
R: 15.7%
Rfree: 17.5%
Resolution: 1.28Å
Deposited: 2020-06-26
Released:
Title: The crystal structure of 3CL MainPro of SARS-CoV-2 with oxidized Cys145 (Sulfenic acid cysteine)
Authors: K.Tan, N.I. Maltseva, L.F. Welk, R.P. Jedrzejczak, L. Coates, A.Y. Kovalevskyi, A. Joachimiak, Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 6XKF (PDBSUM) (Profunc) (GPSS) (MMDB)
Other ligands: ,
R: 19.2%
Rfree: 23.9%
Resolution: 1.8Å
Deposited: 2020-06-26
Released:

Target IDP52003

Title: The crystal structure of Papain-Like Protease of SARS CoV-2 , C111S mutant, at room temperature
Authors: Osipiuk, J., Tesar, C., Jedrzejczak, R., Endres, M., Joachimiak, A., Center for Structural Genomics of Infectious Diseases (CSGID)
PDB 6XG3 (PDBSUM) (Profunc) (GPSS) (MMDB)
Complexed with:
Other ligands: ,
R: 15.4%
Rfree: 19.3%
Resolution: 2.48Å
Deposited: 2020-06-16
Released: 2020-06-24
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