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4XG9
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BU of 4xg9 by Molmil
Crystal structure of an inhibitor-bound Syk
分子名称: 1-[(1-{2-[(3-chloro-1,2-dimethyl-1H-indol-5-yl)amino]pyrimidin-4-yl}-3-methyl-1H-pyrazol-4-yl)methyl]azetidin-3-ol, Tyrosine-protein kinase SYK
著者Lee, S.J, Choi, J, Han, B.G, Song, H, Koh, J.S, Lee, B.I.
登録日2014-12-30
公開日2015-12-30
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.91 Å)
主引用文献Crystal structures of spleen tyrosine kinase in complex with novel inhibitors: structural insights for design of anticancer drugs
Febs J., 283, 2016
4X63
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BU of 4x63 by Molmil
Crystal structure of PRMT5:MEP50 with EPZ015666 and SAH
分子名称: Methylosome protein 50, N-[(2S)-3-(3,4-dihydroisoquinolin-2(1H)-yl)-2-hydroxypropyl]-6-(oxetan-3-ylamino)pyrimidine-4-carboxamide, Protein arginine N-methyltransferase 5, ...
著者Boriack-Sjodin, P.A.
登録日2014-12-06
公開日2015-04-22
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (3.05 Å)
主引用文献A selective inhibitor of PRMT5 with in vivo and in vitro potency in MCL models.
Nat.Chem.Biol., 11, 2015
2V1V
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BU of 2v1v by Molmil
3D STRUCTURE OF THE M8L MUTANT OF SQUASH TRYPSIN INHIBITOR CMTI-I
分子名称: TRYPSIN INHIBITOR 1
著者Sledz, P, Bolewska, K, Bierzynski, A, Zhukov, I.
登録日2007-05-30
公開日2007-06-19
最終更新日2024-11-13
実験手法SOLUTION NMR
主引用文献Conservative mutation Met8 --> Leu affects the folding process and structural stability of squash trypsin inhibitor CMTI-I.
Protein Sci., 9, 2000
6ZGL
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BU of 6zgl by Molmil
Structure of DPS determined by movement-free cryoEM with zero dose extrapolation
分子名称: DNA protection during starvation protein
著者Naydenova, K, Russo, C.J.
登録日2020-06-19
公開日2020-10-21
最終更新日2024-05-01
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献Cryo-EM with sub-1 angstrom specimen movement.
Science, 370, 2020
5A3N
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BU of 5a3n by Molmil
Crystal structure of human PLU-1 (JARID1B) in complex with KDOAM25a
分子名称: 1,2-ETHANEDIOL, 2-[[[2-[2-(dimethylamino)ethyl-ethyl-amino]-2-oxidanylidene-ethyl]amino]methyl]pyridine-4-carboxamide, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ...
著者Srikannathasan, V, Johansson, C, Gileadi, C, Nuzzi, A, Ruda, G.F, Kopec, J, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Brennan, P, Oppermann, U.
登録日2015-06-02
公開日2015-07-08
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Potent and Selective KDM5 Inhibitor Stops Cellular Demethylation of H3K4me3 at Transcription Start Sites and Proliferation of MM1S Myeloma Cells.
Cell Chem Biol, 24, 2017
5BS0
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BU of 5bs0 by Molmil
MAGE-A3 Reactive TCR in complex with Titin Epitope in HLA-A1
分子名称: Beta-2-microglobulin, GLYCEROL, HLA class I histocompatibility antigen, ...
著者Raman, M.C.C, Rizkallah, P.J, Simmons, R, Donellan, Z, Dukes, J, Bossi, G, LeProvost, G, Mahon, T, Hickman, E, Lomax, M, Oates, J, Hassan, N, Vuidepot, A, Sami, M, Cole, D.K, Jakobsen, B.K.
登録日2015-06-01
公開日2016-03-02
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Direct molecular mimicry enables off-target cardiovascular toxicity by an enhanced affinity TCR designed for cancer immunotherapy.
Sci Rep, 6, 2016
1AJ6
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BU of 1aj6 by Molmil
NOVOBIOCIN-RESISTANT MUTANT (R136H) OF THE N-TERMINAL 24 KDA FRAGMENT OF DNA GYRASE B COMPLEXED WITH NOVOBIOCIN AT 2.3 ANGSTROMS RESOLUTION
分子名称: GYRASE, NOVOBIOCIN
著者Weston, S.A, Tunnicliffe, A, Pauptit, R.A.
登録日1997-05-15
公開日1998-05-20
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献The entropic penalty of ordered water accounts for weaker binding of the antibiotic novobiocin to a resistant mutant of DNA gyrase: a thermodynamic and crystallographic study.
Biochemistry, 36, 1997
5B1S
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BU of 5b1s by Molmil
Crystal structure of Trypanosoma cruzi spermidine synthase in complex with 2-(2-fluorophenyl)ethanamine
分子名称: 2-(2-fluorophenyl)ethanamine, 5'-[(S)-(3-AMINOPROPYL)(METHYL)-LAMBDA~4~-SULFANYL]-5'-DEOXYADENOSINE, Spermidine synthase, ...
著者Amano, Y, Tateishi, Y.
登録日2015-12-17
公開日2016-12-21
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献In silico, in vitro, X-ray crystallography, and integrated strategies for discovering spermidine synthase inhibitors for Chagas disease
Sci Rep, 7, 2017
3I6Y
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BU of 3i6y by Molmil
Structure of an esterase from the oil-degrading bacterium Oleispira antarctica
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
著者Singer, A.U, Evdokimova, E, Kagan, O, Edwards, A.M, Joachimiak, A, Savchenko, A, Midwest Center for Structural Genomics (MCSG)
登録日2009-07-07
公開日2009-07-28
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structure and activity of the cold-active and anion-activated carboxyl esterase OLEI01171 from the oil-degrading marine bacterium Oleispira antarctica.
Biochem.J., 445, 2012
5BRZ
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BU of 5brz by Molmil
MAGE-A3 reactive TCR in complex with MAGE-A3 in HLA-A1
分子名称: Beta-2-microglobulin, GLU-VAL-ASP-PRO-ILE-GLY-HIS-LEU-TYR, HLA class I histocompatibility antigen, ...
著者Raman, M.C.C, Rizkallah, P.J, Simmons, R, Donnellan, Z, Dukes, J, Bossi, G, LeProvost, G, Mahon, T, Hickman, E, LomaX, M, Oates, J, Hassan, N, Vuidepot, A, Sami, M, Cole, D.K, Jakobsen, B.K.
登録日2015-06-01
公開日2016-03-02
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.62 Å)
主引用文献Direct molecular mimicry enables off-target cardiovascular toxicity by an enhanced affinity TCR designed for cancer immunotherapy.
Sci Rep, 6, 2016
3W57
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BU of 3w57 by Molmil
Structure of a C2 domain
分子名称: C2 domain protein, CALCIUM ION
著者Traore, D.A.K, Whisstock, J.C.
登録日2013-01-24
公開日2013-10-23
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.662 Å)
主引用文献Defining the interaction of perforin with calcium and the phospholipid membrane.
Biochem.J., 456, 2013
8RPM
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BU of 8rpm by Molmil
Lysozyme structure based on automated real-time serial crystallography data processing using CrystFEL
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者White, T.A, Oberthuer, D, Henkel, A.
登録日2024-01-16
公開日2024-02-21
最終更新日2025-01-22
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Real-time data processing for serial crystallography experiments.
Iucrj, 12, 2025
3CTI
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BU of 3cti by Molmil
RELAXATION MATRIX REFINEMENT OF THE SOLUTION STRUCTURE OF SQUASH TRYPSIN INHIBITOR
分子名称: TRYPSIN INHIBITOR
著者Nilges, M, Habazettl, J, Bruenger, A.T, Holak, T.A.
登録日1991-03-27
公開日1992-04-15
最終更新日2024-10-23
実験手法SOLUTION NMR
主引用文献Relaxation matrix refinement of the solution structure of squash trypsin inhibitor.
J.Mol.Biol., 219, 1991
6LA2
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BU of 6la2 by Molmil
343 bp di-nucleosome harboring cohesive DNA termini assembled with linker histone H1.0
分子名称: DNA (343-MER), Histone H1.0, Histone H2A type 1-B/E, ...
著者Adhireksan, Z, Sharma, D, Lee, P.L, Davey, C.A.
登録日2019-11-11
公開日2021-02-17
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.89 Å)
主引用文献Engineering nucleosomes for generating diverse chromatin assemblies.
Nucleic Acids Res., 49, 2021
6LER
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BU of 6ler by Molmil
169 bp nucleosome harboring non-identical cohesive DNA termini.
分子名称: CALCIUM ION, DNA (169-MER), Histone H2A type 1-B/E, ...
著者Sharma, D, Adhireksan, Z, Lee, P.L, Davey, C.A.
登録日2019-11-26
公開日2021-03-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Engineering nucleosomes for generating diverse chromatin assemblies.
Nucleic Acids Res., 49, 2021
6M8O
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BU of 6m8o by Molmil
Crystal structure of the receiver domain of LytR from Staphylococcus aureus
分子名称: DNA-binding response regulator, SULFATE ION
著者Shala-Lawrence, A, Audette, G.F.
登録日2018-08-22
公開日2018-09-19
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of the receiver domain of LytR from Staphylococcus aureus
To Be Published
3E6R
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BU of 3e6r by Molmil
Crystal structure of apo-ferritin from Pseudo-nitzschia multiseries
分子名称: Ferritin, SULFATE ION
著者Murphy, M.E.P, Arrieta, A.L.
登録日2008-08-15
公開日2008-11-25
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Ferritin is used for iron storage in bloom-forming marine pennate diatoms.
Nature, 457, 2009
5LU6
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BU of 5lu6 by Molmil
Heptose isomerase mutant - H64Q
分子名称: 1,2-ETHANEDIOL, D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATE, GLYCEROL, ...
著者Vivoli, M, Harmer, N.J, Pang, J.
登録日2016-09-08
公開日2017-12-06
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.67 Å)
主引用文献A half-site multimeric enzyme achieves its cooperativity without conformational changes.
Sci Rep, 7, 2017
3E6S
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BU of 3e6s by Molmil
Crystal structure of ferritin soaked with iron from Pseudo-nitzschia multiseries
分子名称: FE (III) ION, Ferritin, SULFATE ION
著者Murphy, M.E.P, Arrieta, A.L.
登録日2008-08-15
公開日2008-11-25
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Ferritin is used for iron storage in bloom-forming marine pennate diatoms.
Nature, 457, 2009
6BX8
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BU of 6bx8 by Molmil
Human Mesotrypsin (PRSS3) Complexed with Tissue Factor Pathway Inhibitor Variant (TFPI1-KD1-K15R-I17C-I34C)
分子名称: SULFATE ION, Tissue factor pathway inhibitor, Trypsin-3
著者Coban, M, Sankaran, B, Cohen, I, Hockla, A, Papo, N, Radisky, E.S.
登録日2017-12-18
公開日2019-02-06
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Disulfide engineering of human Kunitz-type serine protease inhibitors enhances proteolytic stability and target affinity toward mesotrypsin.
J. Biol. Chem., 294, 2019
8THQ
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BU of 8thq by Molmil
Nonamer RNA bound to hAgo2-PAZ
分子名称: Protein argonaute-2, RNA (5'-R(*CP*GP*UP*GP*AP*CP*UP*CP*U)-3')
著者Pallan, P.S, Harp, J.M, Egli, M.
登録日2023-07-17
公開日2024-10-16
実験手法X-RAY DIFFRACTION (2.41 Å)
主引用文献Single-Stranded Hairpin Loop RNAs (loopmeRNAs) Potently Induce Gene Silencing through the RNA Interference Pathway.
J.Am.Chem.Soc., 2024
5XGX
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BU of 5xgx by Molmil
Crystal structure of colwellia psychrerythraea strain 34H isoaspartyl dipeptidase E80Q mutant complexed with beta-isoaspartyl lysine
分子名称: D-ASPARTIC ACID, D-LYSINE, Isoaspartyl dipeptidase, ...
著者Lee, J.H, Lee, C.W, Park, S.H.
登録日2017-04-18
公開日2018-02-28
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.33 Å)
主引用文献Crystal structure and functional characterization of an isoaspartyl dipeptidase (CpsIadA) from Colwellia psychrerythraea strain 34H.
PLoS ONE, 12, 2017
8U7F
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Crystal structure of CIB_12 beta-galactosidase from Cuniculiplasma divulgatum
分子名称: CIB_12 Beta-galactosidase, GLYCEROL
著者Stogios, P.J, Skarina, T, Di Leo, R, Yakunin, A, Golyshin, P, Savchenko, A.
登録日2023-09-15
公開日2024-07-24
最終更新日2025-02-05
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Moderately thermostable GH1 beta-glucosidases from hyperacidophilic archaeon Cuniculiplasma divulgatum S5.
Fems Microbiol.Ecol., 100, 2024
8U7G
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BU of 8u7g by Molmil
Crystal structure of CIB_13 beta-galactosidase from Cuniculiplasma divulgatum
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CIB_13 Beta-galactosidase, GLYCEROL
著者Stogios, P.J.
登録日2023-09-15
公開日2024-07-24
最終更新日2025-02-05
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Moderately thermostable GH1 beta-glucosidases from hyperacidophilic archaeon Cuniculiplasma divulgatum S5.
Fems Microbiol.Ecol., 100, 2024
6UDC
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BU of 6udc by Molmil
Spectroscopic and structural characterization of a genetically encoded direct sensor for protein-ligand interactions
分子名称: BIOTIN, Streptavidin
著者Mills, J.H, Gleason, P.R, Simmons, C.R, Henderson, J.N, Kartchner, B.K.
登録日2019-09-19
公開日2020-09-23
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Structural Origins of Altered Spectroscopic Properties upon Ligand Binding in Proteins Containing a Fluorescent Noncanonical Amino Acid.
Biochemistry, 60, 2021

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件を2025-07-09に公開中

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