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7H90
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BU of 7h90 by Molmil
Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain -- Crystal structure of Chikungunya virus nsP3 macrodomain in complex with Z1378432729 (CHIKV_MacB-x1337)
Descriptor: 1-benzofuran-2-sulfonamide, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CHLORIDE ION, ...
Authors:Aschenbrenner, J.C, Fairhead, M, Godoy, A.S, Balcomb, B.H, Capkin, E, Chandran, A.V, Dolci, I, Golding, M, Koekemoer, L, Lithgo, R.M, Marples, P.G, Ni, X, Oliva, G, Thompson, W, Tomlinson, C.W.E, Wild, C, Winokan, M, Xavier, M.-A.E, Fearon, D, von Delft, F.
Deposit date:2024-04-26
Release date:2024-05-29
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Group deposition for crystallographic fragment screening of Chikungunya virus nsP3 macrodomain
To Be Published
7H57
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BU of 7h57 by Molmil
Crystal structure of endothiapepsin PF_cryo1 in complex with AC39729 at 100 K
Descriptor: 5-fluoranylpyridin-2-amine, DIMETHYL SULFOXIDE, Endothiapepsin
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.988 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
5WPB
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BU of 5wpb by Molmil
Crystal structure of fragment 3-(3-(pyridin-2-ylmethoxy)quinoxalin-2-yl)propanoic acid bound in the ubiquitin binding pocket of the HDAC6 zinc-finger domain
Descriptor: 3-{3-[(pyridin-2-yl)methoxy]quinoxalin-2-yl}propanoic acid, Histone deacetylase 6, UNKNOWN ATOM OR ION, ...
Authors:Harding, R.J, Tempel, W, Ferreira de Freitas, R, Franzoni, I, Ravichandran, M, Lautens, M, Santhakumar, V, Schapira, M, Bountra, C, Edwards, A.M, Arrowsmith, C.H, Structural Genomics Consortium (SGC)
Deposit date:2017-08-04
Release date:2017-08-23
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Small Molecule Antagonists of the Interaction between the Histone Deacetylase 6 Zinc-Finger Domain and Ubiquitin.
J. Med. Chem., 60, 2017
8C2R
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BU of 8c2r by Molmil
SARS-CoV2 Omicron BA.1 spike in complex with CAB-A17 antibody
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CAB-A17 antibody (HC), ...
Authors:Das, H, Hallberg, B.M.
Deposit date:2022-12-22
Release date:2024-05-22
Last modified:2024-09-25
Method:ELECTRON MICROSCOPY (2.56 Å)
Cite:SARS-CoV-2 omicron Spike (RBD) in complex with CAB-A17 antibody
To Be Published
8CFZ
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BU of 8cfz by Molmil
Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with F2X-Entry library fragment H09
Descriptor: 1-[2,4-bis(fluoranyl)phenyl]-2-(3,4-dihydro-1,2,4-triazol-2-yl)ethanone, ADENINE, Adenosylhomocysteinase, ...
Authors:Malecki, P.H, Gawel, M, Stepniewska, M, Brzezinski, K.
Deposit date:2023-02-03
Release date:2024-05-22
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Crystal structure of S-adenosyl-L-homocysteine hydrolase from P. aeruginosa in complex with fragment F2X-Entry H09
To be published
7H59
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BU of 7h59 by Molmil
Crystal structure of endothiapepsin IS_cryo3 in complex with AC39729 at 100 K
Descriptor: 5-fluoranylpyridin-2-amine, DIMETHYL SULFOXIDE, Endothiapepsin
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (2 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7H5C
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BU of 7h5c by Molmil
Crystal structure of endothiapepsin PN_cryo3 in complex with AC40075 at 100 K
Descriptor: ACETATE ION, DIMETHYL SULFOXIDE, Endothiapepsin, ...
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.906 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7USA
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BU of 7usa by Molmil
Structure of the human coronavirus CCoV-HuPn-2018 spike glycoprotein with domain 0 in the swung out conformation
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, ...
Authors:Tortorici, M.A, Veesler, D, Seattle Structural Genomics Center for Infectious Disease (SSGCID)
Deposit date:2022-04-23
Release date:2022-08-24
Method:ELECTRON MICROSCOPY (2.8 Å)
Cite:Structure, receptor recognition, and antigenicity of the human coronavirus CCoV-HuPn-2018 spike glycoprotein.
Cell, 185, 2022
7UNM
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BU of 7unm by Molmil
Human TMEM175 in an closed state
Descriptor: Endosomal/lysosomal potassium channel TMEM175, POTASSIUM ION
Authors:Oh, S, Hite, R.K.
Deposit date:2022-04-11
Release date:2022-06-29
Last modified:2024-02-14
Method:ELECTRON MICROSCOPY (2.61 Å)
Cite:Differential ion dehydration energetics explains selectivity in the non-canonical lysosomal K + channel TMEM175.
Elife, 11, 2022
7H5G
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BU of 7h5g by Molmil
Crystal structure of endothiapepsin PF_cryo1 in complex with AC40075 at 100 K
Descriptor: ACETATE ION, DIMETHYL SULFOXIDE, Endothiapepsin, ...
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.887 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7UVY
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BU of 7uvy by Molmil
A. baumannii ribosome-Streptothricin-D complex: 70S with P-site tRNA
Descriptor: 16s Ribosomal RNA, 23s ribosomal RNA, 30S ribosomal protein S10, ...
Authors:Morgan, C.E, Yu, E.W.
Deposit date:2022-05-02
Release date:2023-04-19
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (2.39 Å)
Cite:Streptothricin F is a bactericidal antibiotic effective against highly drug-resistant gram-negative bacteria that interacts with the 30S subunit of the 70S ribosome.
Plos Biol., 21, 2023
4YUU
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BU of 4yuu by Molmil
Crystal structure of oxygen-evolving photosystem II from a red alga
Descriptor: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, ...
Authors:Ago, H, Shen, J.-R.
Deposit date:2015-03-19
Release date:2016-01-20
Last modified:2020-02-05
Method:X-RAY DIFFRACTION (2.7700038 Å)
Cite:Novel Features of Eukaryotic Photosystem II Revealed by Its Crystal Structure Analysis from a Red Alga
J.Biol.Chem., 291, 2016
7H5L
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BU of 7h5l by Molmil
Crystal structure of endothiapepsin PN_cryo3 in complex with TL00150 at 100 K
Descriptor: DIMETHYL SULFOXIDE, Endothiapepsin, [4-(trifluoromethyl)phenyl]methanamine
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.856 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7UVV
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BU of 7uvv by Molmil
A. baumannii ribosome-Streptothricin-F complex: 70S with P-site tRNA
Descriptor: 16s Ribosomal RNA, 23s ribosomal RNA, 30S ribosomal protein S10, ...
Authors:Morgan, C.E, Yu, E.W.
Deposit date:2022-05-02
Release date:2023-04-19
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (2.5 Å)
Cite:Streptothricin F is a bactericidal antibiotic effective against highly drug-resistant gram-negative bacteria that interacts with the 30S subunit of the 70S ribosome.
Plos Biol., 21, 2023
7H56
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BU of 7h56 by Molmil
Crystal structure of endothiapepsin PF_cryo3 in complex with AC39729 at 100 K
Descriptor: DIMETHYL SULFOXIDE, Endothiapepsin
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.987 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7UVZ
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BU of 7uvz by Molmil
A. baumannii ribosome-Streptothricin-D complex: 70S with E-site tRNA
Descriptor: 16s Ribosomal RNA, 23s ribosomal RNA, 30S ribosomal protein S10, ...
Authors:Morgan, C.E, Yu, E.W.
Deposit date:2022-05-02
Release date:2023-04-19
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (2.21 Å)
Cite:Streptothricin F is a bactericidal antibiotic effective against highly drug-resistant gram-negative bacteria that interacts with the 30S subunit of the 70S ribosome.
Plos Biol., 21, 2023
7H5M
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BU of 7h5m by Molmil
Crystal structure of endothiapepsin PN_cryo1 in complex with TL00150 at 100 K
Descriptor: ACETATE ION, DIMETHYL SULFOXIDE, Endothiapepsin, ...
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.853 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7UVX
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BU of 7uvx by Molmil
A. baumannii 70S ribosome-Streptothricin-F complex
Descriptor: 16s Ribosomal RNA, 23s ribosomal RNA, 30S ribosomal protein S10, ...
Authors:Morgan, C.E, Yu, E.W.
Deposit date:2022-05-02
Release date:2023-04-19
Last modified:2024-06-12
Method:ELECTRON MICROSCOPY (2.35 Å)
Cite:Streptothricin F is a bactericidal antibiotic effective against highly drug-resistant gram-negative bacteria that interacts with the 30S subunit of the 70S ribosome.
Plos Biol., 21, 2023
7UOW
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BU of 7uow by Molmil
SARS-Cov2 S protein structure in complex with neutralizing monoclonal antibody 034_32
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Monoclonal antibody 034_32 heavy chain, ...
Authors:Patel, A, Ortlund, E.
Deposit date:2022-04-14
Release date:2023-04-19
Last modified:2023-09-13
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:Molecular basis of SARS-CoV-2 Omicron variant evasion from shared neutralizing antibody response.
Structure, 31, 2023
7H5P
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BU of 7h5p by Molmil
Crystal structure of endothiapepsin PF_cryo1 in complex with TL00150 at 100 K
Descriptor: ACETATE ION, DIMETHYL SULFOXIDE, Endothiapepsin, ...
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.986 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7H5D
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BU of 7h5d by Molmil
Crystal structure of endothiapepsin PN_cryo1 in complex with AC40075 at 100 K
Descriptor: ACETATE ION, DIMETHYL SULFOXIDE, Endothiapepsin, ...
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.907 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7H5U
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BU of 7h5u by Molmil
Crystal structure of endothiapepsin PF_cryo3 in complex with JFD03909 at 100 K
Descriptor: DIMETHYL SULFOXIDE, Endothiapepsin
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
7H5V
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BU of 7h5v by Molmil
Crystal structure of endothiapepsin PF_cryo1 in complex with JFD03909 at 100 K
Descriptor: 1,10-PHENANTHROLINE, DIMETHYL SULFOXIDE, Endothiapepsin
Authors:Huang, C.-Y, Aumonier, S, Olieric, V, Wang, M.
Deposit date:2024-04-10
Release date:2024-08-07
Last modified:2024-08-21
Method:X-RAY DIFFRACTION (1.985 Å)
Cite:Cryo2RT: a high-throughput method for room-temperature macromolecular crystallography from cryo-cooled crystals.
Acta Crystallogr D Struct Biol, 80, 2024
8CAS
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BU of 8cas by Molmil
Cryo-EM structure of native Otu2-bound ubiquitinated 48S initiation complex (partial)
Descriptor: 18S ribosomal RNA, 40S ribosomal protein S0-A, 40S ribosomal protein S1-A, ...
Authors:Ikeuchi, K, Buschauer, R, Cheng, J, Berninghausen, O, Becker, T, Beckmann, R.
Deposit date:2023-01-24
Release date:2023-05-24
Last modified:2024-07-24
Method:ELECTRON MICROSCOPY (3.3 Å)
Cite:Molecular basis for recognition and deubiquitination of 40S ribosomes by Otu2.
Nat Commun, 14, 2023
5WTR
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BU of 5wtr by Molmil
Crystal structure of a prokaryotic TRIC channel in 0.5 M KCl
Descriptor: 1,2-ETHANEDIOL, POTASSIUM ION, TRISTEAROYLGLYCEROL, ...
Authors:Ou, X.M, Wang, L.F, Yang, H.T, Liu, X.Y, Liu, Z.F.
Deposit date:2016-12-14
Release date:2017-04-05
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Ion and water binding sites inside an occluded hourglass pore of a TRIC channel
BMC BIOL., 2017

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PDB entries from 2024-10-02

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