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PDB: 217686 results Info pages Status search Chemie search BIRD

Crystal structure of Tyr24 phosphorylated Annexin A2 at 3.4 A resolution
Descriptor:	Annexin A2, CALCIUM ION
Authors:	Ecsedi, P, Gogl, G, Kiss, B, Nyitray, L.
Deposit date:	2016-08-15
Release date:	2017-07-05
Last modified:	2024-01-10
Method:	X-RAY DIFFRACTION (3.4 Å)
Cite:	Regulation of the Equilibrium between Closed and Open Conformations of Annexin A2 by N-Terminal Phosphorylation and S100A4-Binding. Structure, 25, 2017

5JX7

Cysteine mutant (C224A) structure of As (III) S-adenosyl methyltransferase
Descriptor:	Arsenic methyltransferase, CALCIUM ION
Authors:	Packianathan, C, Marapakala, K, Ajees, A.A, Kandavelu, P, Sankaran, B, Rosen, B.P.
Deposit date:	2016-05-12
Release date:	2017-05-17
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.3 Å)
Cite:	Cysteine mutant (C224A) structure of As (III) S-adenosyl methyltransferase To be Published

5M0Y

Crystal Structure of the CohScaA-XDocCipB type II complex from Clostridium thermocellum at 1.5Angstrom resolution
Descriptor:	1,2-ETHANEDIOL, CALCIUM ION, Cellulosome anchoring protein cohesin region, ...
Authors:	Pinheiro, B.A, Bras, J.L, Carvalho, A.L, Fontes, C.M.G.A.
Deposit date:	2016-10-06
Release date:	2017-09-06
Last modified:	2024-01-17
Method:	X-RAY DIFFRACTION (1.5 Å)
Cite:	Diverse specificity of cellulosome attachment to the bacterial cell surface. Sci Rep, 6, 2016

5JYE

Structures of Streptococcus agalactiae GBS GAPDH in different enzymatic states
Descriptor:	Glyceraldehyde-3-phosphate dehydrogenase, MAGNESIUM ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE
Authors:	Schormann, N, Chattopadhyay, D.
Deposit date:	2016-05-13
Release date:	2016-12-21
Last modified:	2024-04-03
Method:	X-RAY DIFFRACTION (2.23 Å)
Cite:	Crystal Structures of Group B Streptococcus Glyceraldehyde-3-Phosphate Dehydrogenase: Apo-Form, Binary and Ternary Complexes. PLoS ONE, 11, 2016

8TZN

Crystal structure of 10E8-GT10.2 HIV-1 MPER scaffold in complex with a non-human primate W3-01 Fab
Descriptor:	10E8-GT10.2 MPER scaffold, W3-01 Fab Heavy Chain, W3-01 Fab Light Chain
Authors:	Lee, C.C.D, Wilson, I.A.
Deposit date:	2023-08-27
Release date:	2024-06-12
Last modified:	2024-06-19
Method:	X-RAY DIFFRACTION (3.11 Å)
Cite:	Vaccination induces broadly neutralizing antibody precursors to HIV gp41. Nat.Immunol., 25, 2024

6WW1

Crystal structure of the LmFPPS mutant E97Y
Descriptor:	3-butyl-1-(2,2-diphosphonoethyl)pyridinium, ACETATE ION, CALCIUM ION, ...
Authors:	Maheshwari, S, Kim, Y.S, Gabelli, S.B.
Deposit date:	2020-05-07
Release date:	2020-10-07
Last modified:	2023-10-18
Method:	X-RAY DIFFRACTION (2.05 Å)
Cite:	Identifying Structural Determinants of Product Specificity in Leishmania major Farnesyl Diphosphate Synthase. Biochemistry, 59, 2020

6MQR

Vaccine-elicited NHP FP-targeting neutralizing antibody 0PV-a.01 in complex with FP (residue 512-519)
Descriptor:	CALCIUM ION, HIV fusion peptide residue 512-519, SULFATE ION, ...
Authors:	Xu, K, Wang, Y, Kwong, P.D.
Deposit date:	2018-10-10
Release date:	2019-07-31
Last modified:	2019-11-13
Method:	X-RAY DIFFRACTION (2.45 Å)
Cite:	Antibody Lineages with Vaccine-Induced Antigen-Binding Hotspots Develop Broad HIV Neutralization. Cell, 178, 2019

5K8B

X-ray structure of KdnA, 8-amino-3,8-dideoxy-alpha-D-manno-octulosonate transaminase, from Shewanella oneidensis in the presence of the external aldimine with PLP and glutamate
Descriptor:	8-amino-3,8-dideoxy-alpha-D-manno-octulosonate transaminase, CHLORIDE ION, N-({3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN-4-YL}METHYL)-D-GLUTAMIC ACID, ...
Authors:	Holden, H.M, Thoden, J.B, Zachman-Brockmeyer, T.R.
Deposit date:	2016-05-28
Release date:	2016-06-15
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2.15 Å)
Cite:	Structures of KdnB and KdnA from Shewanella oneidensis: Key Enzymes in the Formation of 8-Amino-3,8-Dideoxy-d-Manno-Octulosonic Acid. Biochemistry, 55, 2016

6N0U

Crystal structure of a glucose-1-phosphate thymidylyltransferase from Burkholderia phymatum bound to 2'-deoxy-thymidine-B-L-rhamnose
Descriptor:	1,2-ETHANEDIOL, 2'-DEOXY-THYMIDINE-BETA-L-RHAMNOSE, Glucose-1-phosphate thymidylyltransferase
Authors:	Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:	2018-11-07
Release date:	2018-11-21
Last modified:	2023-10-11
Method:	X-RAY DIFFRACTION (2.1 Å)
Cite:	Crystal structure of a glucose-1-phosphate thymidylyltransferase from Burkholderia phymatum bound to 2'-deoxy-thymidine-B-L-rhamnose To Be Published

5KBF

cAMP bound PfPKA-R (141-441)
Descriptor:	ADENOSINE-3',5'-CYCLIC-MONOPHOSPHATE, CAMP-dependent protein kinase regulatory subunit, putative
Authors:	Littler, D.R, Gilson, P.R, Crabb, B.S, Rossjohn, J.J.
Deposit date:	2016-06-03
Release date:	2016-10-12
Last modified:	2023-09-27
Method:	X-RAY DIFFRACTION (2 Å)
Cite:	Disrupting the Allosteric Interaction between the Plasmodium falciparum cAMP-dependent Kinase and Its Regulatory Subunit. J. Biol. Chem., 291, 2016

7GD4

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with ALP-POS-c59291d4-2 (Mpro-x10871)
Descriptor:	3C-like proteinase, DIMETHYL SULFOXIDE, N-{4-[(1H-benzotriazol-1-ylacetyl)(thiophen-3-ylmethyl)amino]phenyl}propanamide
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.749 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GDA

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with TRY-UNI-2eddb1ff-3 (Mpro-x10900)
Descriptor:	(2R)-2-(5-chloropyridin-3-yl)-N-(4-methylpyridin-3-yl)propanamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.709 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GBL

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with RAL-MED-2de63afb-1 (Mpro-x10371)
Descriptor:	3C-like proteinase, DIMETHYL SULFOXIDE, N-(3-{[(2S)-4-oxoazetidin-2-yl]oxy}phenyl)-2-(pyridin-3-yl)acetamide
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (2.16 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GDK

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with EDG-MED-0da5ad92-21 (Mpro-x11025)
Descriptor:	2-(3-chlorophenyl)-N-(3-methyl-1H-pyrazol-4-yl)acetamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.735 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

6CRZ

SARS Spike Glycoprotein, Trypsin-cleaved, Stabilized variant, C3 symmetry
Descriptor:	2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein,Fibritin, ...
Authors:	Kirchdoerfer, R.N, Wang, N, Pallesen, J, Turner, H.L, Cottrell, C.A, McLellan, J.S, Ward, A.B.
Deposit date:	2018-03-19
Release date:	2018-04-11
Last modified:	2020-07-29
Method:	ELECTRON MICROSCOPY (3.3 Å)
Cite:	Stabilized coronavirus spikes are resistant to conformational changes induced by receptor recognition or proteolysis. Sci Rep, 8, 2018

7GC1

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with MAT-POS-590ac91e-25 (Mpro-x10478)
Descriptor:	2-[(1S,5R)-bicyclo[3.1.0]hexan-1-yl]-N-(4-methylpyridin-3-yl)acetamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.59 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GDR

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with LOR-NOR-30067bb9-2 (Mpro-x11208)
Descriptor:	(3-methylphenyl)methyl (3R)-3-hydroxy-2-oxo-2,3-dihydro-1H-indole-7-carboxylate, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.661 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GCK

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with BAR-COM-0f94fc3d-48 (Mpro-x10638)
Descriptor:	2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-(4-methylpyridin-3-yl)acetamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GE1

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with EDJ-MED-6af13d92-3 (Mpro-x11294)
Descriptor:	3C-like proteinase, 5-methoxy-N-[2-(2-methoxyphenoxy)ethyl]-2-oxo-1,2-dihydroquinoline-4-carboxamide, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.936 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GB9

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with JAN-GHE-83b26c96-11 (Mpro-x10248)
Descriptor:	2-(4-methylphenyl)-N-(4-methylpyridin-3-yl)acetamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.4 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GE6

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with JAG-UCB-a3ef7265-18 (Mpro-x11346)
Descriptor:	2-(3,5-dimethylphenyl)-N-(4-methyl-4H-1,2,4-triazol-3-yl)acetamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.62 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GBO

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with JAN-GHE-83b26c96-20 (Mpro-x10392)
Descriptor:	1-(3-chlorophenyl)-N-(4-methylpyridin-3-yl)cyclopropane-1-carboxamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.619 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GEG

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with EDJ-MED-a364e151-1 (Mpro-x11431)
Descriptor:	2-(3-chlorophenyl)-N-(5,6,7,8-tetrahydroisoquinolin-4-yl)acetamide, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.729 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GEL

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with JAG-UCB-cedd89ab-1 (Mpro-x11475)
Descriptor:	(1M,3P)-1-(3-chlorophenyl)-3-(4-methylpyridin-3-yl)-1,3-dihydro-2H-imidazol-2-one, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.49 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

7GC3

Group deposition SARS-CoV-2 main protease in complex with inhibitors from the COVID Moonshot -- Crystal Structure of SARS-CoV-2 main protease in complex with JAG-UCB-cedd89ab-4 (Mpro-x10488)
Descriptor:	1-[(2S)-2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-2-(pyridin-3-yl)ethan-1-one, 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:	Fearon, D, Aimon, A, Aschenbrenner, J.C, Balcomb, B.H, Bertram, F.K.R, Brandao-Neto, J, Dias, A, Douangamath, A, Dunnett, L, Godoy, A.S, Gorrie-Stone, T.J, Koekemoer, L, Krojer, T, Lithgo, R.M, Lukacik, P, Marples, P.G, Mikolajek, H, Nelson, E, Owen, C.D, Powell, A.J, Rangel, V.L, Skyner, R, Strain-Damerell, C.M, Thompson, W, Tomlinson, C.W.E, Wild, C, Walsh, M.A, von Delft, F.
Deposit date:	2023-08-11
Release date:	2023-11-08
Last modified:	2023-12-06
Method:	X-RAY DIFFRACTION (1.56 Å)
Cite:	Open science discovery of potent noncovalent SARS-CoV-2 main protease inhibitors. Science, 382, 2023

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Total results:	217686
Displayed results:	25
Sorted by:	Hit score (from highest)
Query:	b