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8GQ1
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BU of 8gq1 by Molmil
HyHEL10 Fab complexed with hen egg lysozyme carrying arginine cluster in framework region of light chain.
Descriptor: Heavy Chain of HyHel10 Antibody Fragment (Fab), Light Chain of HyHel10 Antibody Fragment (Fab), Lysozyme C, ...
Authors:Matsuura, H, Hirata, K, Sakai, N, Nakakido, M, Tsumoto, K.
Deposit date:2022-08-28
Release date:2023-08-30
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (3.13 Å)
Cite:Arginine cluster introduction on framework region in anti-lysozyme antibody improved association rate constant by changing conformational diversity of CDR loops.
Protein Sci., 32, 2023
8GQ0
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BU of 8gq0 by Molmil
Crystal structure of BRD4 bromodomain 1 (BD1) in complex with STL233497
Descriptor: Bromodomain-containing protein 4, FORMIC ACID, GLYCEROL, ...
Authors:Park, T.H, Lee, B.I.
Deposit date:2022-08-27
Release date:2023-01-18
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.44 Å)
Cite:Crystal structure of [1,2,4]triazolo[4,3-b]pyridazine derivatives as BRD4 bromodomain inhibitors and structure-activity relationship study.
Sci Rep, 13, 2023
8GPZ
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BU of 8gpz by Molmil
Crystal structure of BRD4 bromodomain 1 (BD1) in complex with C239-0012
Descriptor: 3-methyl-6-(4-methylpiperidin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine, Bromodomain-containing protein 4, FORMIC ACID, ...
Authors:Park, T.H, Lee, B.I.
Deposit date:2022-08-27
Release date:2023-01-18
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.528 Å)
Cite:Crystal structure of [1,2,4]triazolo[4,3-b]pyridazine derivatives as BRD4 bromodomain inhibitors and structure-activity relationship study.
Sci Rep, 13, 2023
8GPY
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BU of 8gpy by Molmil
Crystal structure of Omicron BA.4/5 RBD in complex with a neutralizing antibody scFv
Descriptor: Spike protein S1, scFv
Authors:Gao, Y.X, Song, Z.D, Wang, W.M, Guo, Y.
Deposit date:2022-08-27
Release date:2023-06-28
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.51 Å)
Cite:Discovery and characterization of potent pan-variant SARS-CoV-2 neutralizing antibodies from individuals with Omicron breakthrough infection.
Nat Commun, 14, 2023
8GPW
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BU of 8gpw by Molmil
Structure of Penicillin-binding protein 3 (PBP3) from Klebsiella pneumoniae with ligand 18G
Descriptor: 1-[(~{Z})-[1-(2-azanyl-1,3-thiazol-4-yl)-2-[[(2~{S})-3-methyl-1-oxidanylidene-3-(sulfooxyamino)butan-2-yl]amino]-2-oxidanylidene-ethylidene]amino]oxycyclopropane-1-carboxylic acid, Peptidoglycan D,D-transpeptidase FtsI
Authors:Song, D.Q, Li, Y.H.
Deposit date:2022-08-27
Release date:2022-11-02
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Structure of Penicillin-binding protein 3 (PBP3) from Klebsiella pneumoniae with ligand 18G at 2.06 Angstroms resolution
To Be Published
8GPP
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BU of 8gpp by Molmil
Acinetobacter baumannii carbonic anhydrase PaaY
Descriptor: BICARBONATE ION, CALCIUM ION, Carbonic anhydrase, ...
Authors:Wen, Y, Jiao, M.
Deposit date:2022-08-26
Release date:2023-05-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Acinetobacter baumannii carbonic anhydrase
Structure, 2023
8GPM
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BU of 8gpm by Molmil
Acinetobacter baumannii carbonic anhydrase
Descriptor: CALCIUM ION, Carbonic anhydrase, GLYCEROL, ...
Authors:Wen, Y, Jiao, M.
Deposit date:2022-08-26
Release date:2023-05-31
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Acinetobacter baumannii carbonic anhydrase
Structure, 2023
8GPK
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BU of 8gpk by Molmil
Crystal structure of human anti-HIV-1 broadly neutralizing antibody F6 Fab
Descriptor: F6 Fab heavy Chain, F6 Fab light chain
Authors:Niu, J, Yang, B.
Deposit date:2022-08-26
Release date:2023-08-09
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (3.34 Å)
Cite:Structures and immune recognition of Env trimers from two Asia prevalent HIV-1 CRFs.
Nat Commun, 14, 2023
8GPJ
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BU of 8gpj by Molmil
HIV-1 Env X16 UFO in complex with 8ANC195 Fab
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 8ANC195 Fab heavy chain, ...
Authors:Niu, J, Xu, Y.W, Yang, B.
Deposit date:2022-08-26
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3.5 Å)
Cite:Structures and immune recognition of Env trimers from two Asia prevalent HIV-1 CRFs.
Nat Commun, 14, 2023
8GPI
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BU of 8gpi by Molmil
HIV-1 Env X18 UFO in complex with 8ANC195 Fab
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 8ANC195 Fab heavy chain, ...
Authors:Niu, J, Xu, Y.W, Yang, B.
Deposit date:2022-08-26
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Structures and immune recognition of Env trimers from two Asia prevalent HIV-1 CRFs.
Nat Commun, 14, 2023
8GPH
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BU of 8gph by Molmil
Crystal structure of protease 3C (C160A mutant) from Seneca Valley Virus
Descriptor: DI(HYDROXYETHYL)ETHER, GLYCEROL, Peptidase C3
Authors:Zhao, H.F, Zhang, H.
Deposit date:2022-08-26
Release date:2023-05-24
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.608 Å)
Cite:Allosteric regulation of Senecavirus A 3Cpro proteolytic activity by an endogenous phospholipid.
Plos Pathog., 19, 2023
8GPG
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BU of 8gpg by Molmil
HIV-1 Env X18 UFO in complex with F6 Fab
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, F6 Fab heavy chain, ...
Authors:Niu, J, Xu, Y.W, Yang, B.
Deposit date:2022-08-26
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (4.1 Å)
Cite:Structures and immune recognition of Env trimers from two Asia prevalent HIV-1 CRFs.
Nat Commun, 14, 2023
8GP6
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BU of 8gp6 by Molmil
Structure of the vaccinia virus A16/G9 sub-complex from the orthopoxvirus entry-fusion complex
Descriptor: GLYCEROL, Myristoylated protein G9, Virion membrane protein A16
Authors:Lu, G.W, Yang, F.L, Lin, S.
Deposit date:2022-08-25
Release date:2023-05-17
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structural basis of poxvirus A16/G9 binding for sub-complex formation.
Emerg Microbes Infect, 12, 2023
8GP5
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BU of 8gp5 by Molmil
Structure of X18 UFO protomer in complex with F6 Fab VHVL domain
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, F6 Fab VH domain, ...
Authors:Niu, J, Xu, Y.W, Yang, B.
Deposit date:2022-08-25
Release date:2023-08-09
Last modified:2023-08-30
Method:ELECTRON MICROSCOPY (4.05 Å)
Cite:Structures and immune recognition of Env trimers from two Asia prevalent HIV-1 CRFs.
Nat Commun, 14, 2023
8GP0
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BU of 8gp0 by Molmil
crystal structure of SulE
Descriptor: Alpha/beta fold hydrolase, CITRIC ACID, GLYCEROL
Authors:Liu, B, Ran, T, wang, W, He, J.
Deposit date:2022-08-25
Release date:2023-08-02
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.46 Å)
Cite:Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity.
Nat Commun, 14, 2023
8GOY
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BU of 8goy by Molmil
SulE P44R
Descriptor: 5-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-1-methyl-pyrazole-4-carboxylic acid, Alpha/beta fold hydrolase, GLYCEROL
Authors:Liu, B, He, J, Ran, T, Wang, W.
Deposit date:2022-08-25
Release date:2023-08-02
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.784 Å)
Cite:Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity.
Nat Commun, 14, 2023
8GOU
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BU of 8gou by Molmil
Omicron BA.4/5 SARS-CoV-2 S in complex with TH003 Fab
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Spike glycoprotein, TH003 Fab heavy chain, ...
Authors:Guo, Y, Zhang, G, Liang, J, Liu, F, Rao, Z.
Deposit date:2022-08-25
Release date:2023-06-28
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Discovery and characterization of potent pan-variant SARS-CoV-2 neutralizing antibodies from individuals with Omicron breakthrough infection.
Nat Commun, 14, 2023
8GOT
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BU of 8got by Molmil
Crystal structure of wild-type protease 3C from Seneca Valley Virus
Descriptor: GLYCEROL, Peptidase C3, [(2~{S})-2-hexadecanoyloxy-3-[[(2~{R})-3-[[(2~{S})-3-[(5~{E},8~{E},11~{Z},14~{E})-icosa-5,8,11,14-tetraenoyl]oxy-2-[(9~{E},12~{Z})-octadeca-9,12-dienoyl]oxy-propoxy]-oxidanyl-phosphoryl]oxy-2-oxidanyl-propoxy]-oxidanyl-phosphoryl]oxy-propyl] icosanoate
Authors:Zhao, H.F, Zhang, H.
Deposit date:2022-08-25
Release date:2023-05-24
Last modified:2024-06-05
Method:X-RAY DIFFRACTION (1.989 Å)
Cite:Allosteric regulation of Senecavirus A 3Cpro proteolytic activity by an endogenous phospholipid.
Plos Pathog., 19, 2023
8GOS
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BU of 8gos by Molmil
Crystal structure of fluorescent protein RasM
Descriptor: RasM
Authors:Adachi, M, Kagotani, Y, Shimizu, R.
Deposit date:2022-08-25
Release date:2023-09-27
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.01 Å)
Cite:Beat-frequency-resolved two-dimensional electronic spectroscopy: disentangling vibrational coherences in artificial fluorescent proteins with sub-10-fs visible laser pulses.
Opt Express, 31, 2023
8GOP
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BU of 8gop by Molmil
SARS-CoV-2 specific private TCR RLQ7
Descriptor: SARS-CoV-2 specific private TCR RLQ7 alpha, SARS-CoV-2 specific private TCR RLQ7 beta
Authors:Wu, D, Mariuzza, R.A.
Deposit date:2022-08-25
Release date:2023-03-01
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural insights into protection against a SARS-CoV-2 spike variant by T cell receptor (TCR) diversity.
J.Biol.Chem., 299, 2023
8GOL
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BU of 8gol by Molmil
crystal structure of SulE
Descriptor: 2-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid, Alpha/beta fold hydrolase, GLYCEROL
Authors:Liu, B, Ran, T, Wang, W, He, J.
Deposit date:2022-08-25
Release date:2023-08-02
Last modified:2024-05-29
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Crystal structures of herbicide-detoxifying esterase reveal a lid loop affecting substrate binding and activity.
Nat Commun, 14, 2023
8GOJ
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BU of 8goj by Molmil
23-residues Heterotetramic Antiparallel Coiled-Coil Derived From LacI
Descriptor: Lac23ys_EE, an acidic mutant of LacI C-terminal tetramerization helix, Lac23ys_KK, ...
Authors:Kumasaka, T.
Deposit date:2022-08-25
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Design of interchain Glu-Arg salt-bridges stabilizing heterotetrameric coiled-coil derived from Lac repressor.
To Be Published
8GOI
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BU of 8goi by Molmil
23-residues Heterotetramic Antiparallel Coiled-Coil Derived From LacI
Descriptor: GLYCEROL, Lac23ys_aEE, an acidic mutant of LacI C-terminal tetramerization helix, ...
Authors:Kumasaka, T.
Deposit date:2022-08-25
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:Design of interchain Glu-Arg salt-bridges stabilizing heterotetrameric coiled-coil derived from Lac repressor.
To Be Published
8GOH
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BU of 8goh by Molmil
Homotetramic Antiparallel Coiled-Coil of 23-residues LacI C-terminal tetramerization helix
Descriptor: LacI C-terminal tetramerization helix, PENTAETHYLENE GLYCOL
Authors:Kumasaka, T.
Deposit date:2022-08-25
Release date:2023-08-30
Method:X-RAY DIFFRACTION (1.1 Å)
Cite:Design of interchain Glu-Arg salt-bridges stabilizing heterotetrameric coiled-coil derived from Lac repressor.
To Be Published
8GOG
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BU of 8gog by Molmil
Structure of streptavidin mutant (S112Y-K121E) complexed with biotin-cyclopentadienyl-rhodium (III)(Cp*-Rh(III))
Descriptor: CHLORIDE ION, GLYCEROL, RHODIUM(III) ION, ...
Authors:Sairaman, A, Mukherjee, P, Maiti, D, Bhaumik, P.
Deposit date:2022-08-24
Release date:2024-02-28
Last modified:2024-05-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Enantiodivergent synthesis of isoindolones catalysed by a Rh(III)-based artificial metalloenzyme
Nat Synth, 2024

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