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5J1A
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BU of 5j1a by Molmil
Antigen presenting molecule
Descriptor: 3-[(8Z,11Z)-pentadeca-8,11-dien-1-yl]benzene-1,2-diol, Beta-2-microglobulin, T-cell surface glycoprotein CD1a
Authors:Yongqing, T, Rossjohn, J, Le Nours, J, Marquez, E, Winau, F.
Deposit date:2016-03-29
Release date:2016-08-03
Last modified:2018-04-04
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:CD1a on Langerhans cells controls inflammatory skin disease.
Nat. Immunol., 17, 2016
8D76
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BU of 8d76 by Molmil
Crystal Structure of EGFR LRTM with compound 24
Descriptor: (3S,4R)-3-fluoro-1-(4-{[8-{3-[(methanesulfonyl)methyl]azetidin-1-yl}-5-(propan-2-yl)-2,7-naphthyridin-3-yl]amino}pyrimidin-2-yl)-3-methylpiperidin-4-ol, Epidermal growth factor receptor, GLYCEROL
Authors:Kim, J.L.
Deposit date:2022-06-07
Release date:2022-07-27
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Discovery of BLU-945, a Reversible, Potent, and Wild-Type-Sparing Next-Generation EGFR Mutant Inhibitor for Treatment-Resistant Non-Small-Cell Lung Cancer.
J.Med.Chem., 65, 2022
8D73
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BU of 8d73 by Molmil
Crystal Structure of EGFR LRTM with compound 7
Descriptor: (3S,4R)-3-fluoro-1-(4-{[4-(methylamino)-1-(propan-2-yl)pyrido[3,4-d]pyridazin-7-yl]amino}pyrimidin-2-yl)piperidin-4-ol, Epidermal growth factor receptor, GLYCEROL
Authors:Kim, J.L.
Deposit date:2022-06-07
Release date:2022-07-27
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Discovery of BLU-945, a Reversible, Potent, and Wild-Type-Sparing Next-Generation EGFR Mutant Inhibitor for Treatment-Resistant Non-Small-Cell Lung Cancer.
J.Med.Chem., 65, 2022
8HTG
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BU of 8htg by Molmil
Crystal structure of Golf in complex with GTP-gamma S and Mg
Descriptor: 1,2-ETHANEDIOL, 5'-GUANOSINE-DIPHOSPHATE-MONOTHIOPHOSPHATE, Guanine nucleotide-binding protein G(olf) subunit alpha, ...
Authors:Kang, H, Choi, H.-J.
Deposit date:2022-12-21
Release date:2023-12-20
Method:X-RAY DIFFRACTION (2.91 Å)
Cite:Understanding the molecular mechanisms of odorant binding and activation of the human OR52 family.
Nat Commun, 14, 2023
5K8Q
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BU of 5k8q by Molmil
Crystal Structure of Calcium-loaded Calmodulin in complex with STRA6 CaMBP2-site peptide.
Descriptor: CALCIUM ION, Calmodulin, IMIDAZOLE, ...
Authors:Stowe, S.D, Clarke, O.B, Cavalier, M.C, Godoy-Ruiz, R, Mancia, F, Weber, D.J.
Deposit date:2016-05-30
Release date:2016-08-24
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.739 Å)
Cite:Structure of the STRA6 receptor for retinol uptake.
Science, 353, 2016
8GVW
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BU of 8gvw by Molmil
Cryo-EM structure of the human TRPC5 ion channel in lipid nanodiscs, class2
Descriptor: (2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (9Z)-octadec-9-enoate, (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, CALCIUM ION, ...
Authors:Won, J, Jeong, H, Lee, H.H.
Deposit date:2022-09-16
Release date:2023-05-24
Method:ELECTRON MICROSCOPY (3.59 Å)
Cite:Molecular architecture of the G alpha i -bound TRPC5 ion channel.
Nat Commun, 14, 2023
8GVX
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BU of 8gvx by Molmil
Cryo-EM structure of the human TRPC5 ion channel in complex with G alpha i3 subunits, class2
Descriptor: (2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (9Z)-octadec-9-enoate, CALCIUM ION, CHOLESTEROL HEMISUCCINATE, ...
Authors:Won, J, Jeong, H, Lee, H.H.
Deposit date:2022-09-16
Release date:2023-05-24
Method:ELECTRON MICROSCOPY (3.91 Å)
Cite:Molecular architecture of the G alpha i -bound TRPC5 ion channel.
Nat Commun, 14, 2023
6A6A
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BU of 6a6a by Molmil
VanYB in complex with D-Alanine
Descriptor: ACETATE ION, D-ALANINE, D-alanyl-D-alanine carboxypeptidase, ...
Authors:Kim, H.S, Hahn, H.
Deposit date:2018-06-27
Release date:2018-09-05
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.26 Å)
Cite:Structural basis for the substrate recognition of peptidoglycan pentapeptides by Enterococcus faecalis VanYB.
Int. J. Biol. Macromol., 119, 2018
8IU0
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BU of 8iu0 by Molmil
Cryo-EM structure of the potassium-selective channelrhodopsin HcKCR1 H225F mutant in lipid nanodisc
Descriptor: (7R,17E,20E)-4-HYDROXY-N,N,N-TRIMETHYL-9-OXO-7-[(PALMITOYLOXY)METHYL]-3,5,8-TRIOXA-4-PHOSPHAHEXACOSA-17,20-DIEN-1-AMINIUM 4-OXIDE, HcKCR1, PALMITIC ACID, ...
Authors:Tajima, S, Kim, Y, Nakamura, S, Yamashita, K, Fukuda, M, Deisseroth, K, Kato, H.E.
Deposit date:2023-03-23
Release date:2023-09-06
Last modified:2024-05-01
Method:ELECTRON MICROSCOPY (2.66 Å)
Cite:Structural basis for ion selectivity in potassium-selective channelrhodopsins.
Cell, 186, 2023
4UAB
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BU of 4uab by Molmil
Crystal structure of a TRAP periplasmic solute binding protein from Chromohalobacter salexigens DSM 3043 (Csal_0678), Target EFI-501078, with bound ethanolamine
Descriptor: CHLORIDE ION, ETHANOLAMINE, Twin-arginine translocation pathway signal
Authors:Vetting, M.W, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Stead, M, Attonito, J.D, Scott Glenn, A, Chowdhury, S, Evans, B, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI)
Deposit date:2014-08-08
Release date:2014-09-03
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:Experimental strategies for functional annotation and metabolism discovery: targeted screening of solute binding proteins and unbiased panning of metabolomes.
Biochemistry, 54, 2015
7X6I
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BU of 7x6i by Molmil
Cryo-EM structure of the human TRPC5 ion channel in complex with G alpha i3 subunits, class1
Descriptor: (2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (9Z)-octadec-9-enoate, CALCIUM ION, CHOLESTEROL HEMISUCCINATE, ...
Authors:Won, J, Jeong, H, Lee, H.H.
Deposit date:2022-03-07
Release date:2023-04-26
Last modified:2023-05-24
Method:ELECTRON MICROSCOPY (3.93 Å)
Cite:Molecular architecture of the G alpha i -bound TRPC5 ion channel.
Nat Commun, 14, 2023
5J1M
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BU of 5j1m by Molmil
Crystal structure of Csd1-Csd2 dimer II
Descriptor: ToxR-activated gene (TagE), ZINC ION
Authors:An, D.R, Suh, S.W.
Deposit date:2016-03-29
Release date:2016-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Structural Basis of the Heterodimer Formation between Cell Shape-Determining Proteins Csd1 and Csd2 from Helicobacter pylori
Plos One, 11, 2016
7X6C
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BU of 7x6c by Molmil
Cryo-EM structure of the human TRPC5 ion channel in lipid nanodiscs, class1
Descriptor: (2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (9Z)-octadec-9-enoate, (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, CALCIUM ION, ...
Authors:Won, J, Jeong, H, Lee, H.H.
Deposit date:2022-03-07
Release date:2023-05-24
Method:ELECTRON MICROSCOPY (3.15 Å)
Cite:Molecular architecture of the G alpha i -bound TRPC5 ion channel.
Nat Commun, 14, 2023
5J1K
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BU of 5j1k by Molmil
Crystal structure of Csd2-Csd2 dimer
Descriptor: GLYCEROL, ToxR-activated gene (TagE)
Authors:An, D.R, Suh, S.W.
Deposit date:2016-03-29
Release date:2016-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Structural Basis of the Heterodimer Formation between Cell Shape-Determining Proteins Csd1 and Csd2 from Helicobacter pylori
Plos One, 11, 2016
5J1L
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BU of 5j1l by Molmil
Crystal structure of Csd1-Csd2 dimer I
Descriptor: ToxR-activated gene (TagE), ZINC ION
Authors:An, D.R, Suh, S.W.
Deposit date:2016-03-29
Release date:2016-10-19
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Structural Basis of the Heterodimer Formation between Cell Shape-Determining Proteins Csd1 and Csd2 from Helicobacter pylori
Plos One, 11, 2016
3UY5
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BU of 3uy5 by Molmil
crystal structure of Eis from Mycobacterium tuberculosis
Descriptor: Enhanced intracellular survival protein
Authors:Kim, K.H, Suh, S.W.
Deposit date:2011-12-05
Release date:2012-05-23
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Mycobacterium tuberculosis Eis protein initiates suppression of host immune responses by acetylation of DUSP16/MKP-7
Proc.Natl.Acad.Sci.USA, 2012
4WG5
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BU of 4wg5 by Molmil
Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1647
Descriptor: 5-amino-3-[7-(cyclobutyloxy)quinolin-3-yl]-1-cyclohexyl-1H-pyrazole-4-carboxamide, Calmodulin-domain protein kinase 1
Authors:Merritt, E.A.
Deposit date:2014-09-17
Release date:2014-10-15
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1647
to be published
4WG3
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BU of 4wg3 by Molmil
Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1610
Descriptor: 3-(7-ethoxynaphthalen-2-yl)-1-(2-methylpropyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, Calmodulin-domain protein kinase 1
Authors:Merritt, E.A.
Deposit date:2014-09-17
Release date:2014-10-15
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1610
to be published
4WG4
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BU of 4wg4 by Molmil
Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1613
Descriptor: 3-(7-ethoxynaphthalen-2-yl)-1-(piperidin-4-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, Calmodulin-domain protein kinase 1
Authors:Merritt, E.A.
Deposit date:2014-09-17
Release date:2014-10-15
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Calcium-Dependent Protein Kinase 1 from Toxoplasma gondii (TgCDPK1) in complex with inhibitor UW1613
to be published
7BYP
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BU of 7byp by Molmil
Lysozyme structure SASE1 from SASE mode
Descriptor: Lysozyme C
Authors:Kang, H.S, Lee, S.J.
Deposit date:2020-04-24
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:High-brightness self-seeded X-ray free-electron laser covering the 3.5 keV to 14.6 keV range
Nat Photonics, 2021
7BYO
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BU of 7byo by Molmil
Lysozyme structure SS1 from SS mode
Descriptor: Lysozyme C
Authors:Kang, H.S, Lee, S.J.
Deposit date:2020-04-24
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:High-brightness self-seeded X-ray free-electron laser covering the 3.5 keV to 14.6 keV range
Nat Photonics, 2021
7D04
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BU of 7d04 by Molmil
Lysozyme structure SS3 from SS mode
Descriptor: Lysozyme C
Authors:Kang, H.S, Lee, S.J.
Deposit date:2020-09-09
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:High-brightness self-seeded X-ray free-electron laser covering the 3.5 keV to 14.6 keV range
Nat Photonics, 2021
7D05
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BU of 7d05 by Molmil
Lysozyme structure SASE3 from SASE mode
Descriptor: Lysozyme C
Authors:Kang, H.S, Lee, S.J.
Deposit date:2020-09-09
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:High-brightness self-seeded X-ray free-electron laser covering the 3.5 keV to 14.6 keV range
Nat Photonics, 2021
7D01
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BU of 7d01 by Molmil
Lysozyme structure SS2 from SS mode
Descriptor: Lysozyme C
Authors:Kang, H.S, Lee, S.J.
Deposit date:2020-09-09
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:High-brightness self-seeded X-ray free-electron laser covering the 3.5 keV to 14.6 keV range
Nat Photonics, 2021
7D02
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BU of 7d02 by Molmil
Lysozyme structure SASE2 from SASE mode
Descriptor: Lysozyme C
Authors:Kang, H.S, Lee, S.J.
Deposit date:2020-09-09
Release date:2021-03-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:High-brightness self-seeded X-ray free-electron laser covering the 3.5 keV to 14.6 keV range
Nat Photonics, 2021

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