Author results

1BG0
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TRANSITION STATE STRUCTURE OF ARGININE KINASE
Descriptor:ARGININE KINASE, NITRATE ION, MAGNESIUM ION, ...
Authors:Zhou, G., Somasundaram, T., Blanc, E., Parthasarathy, G., Ellington, W.R., Chapman, M.S.
Deposit date:1998-06-03
Release date:1998-10-14
Last modified:2018-03-14
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Transition state structure of arginine kinase: implications for catalysis of bimolecular reactions.
Proc.Natl.Acad.Sci.USA, 95, 1998
1FAV
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THE STRUCTURE OF AN HIV-1 SPECIFIC CELL ENTRY INHIBITOR IN COMPLEX WITH THE HIV-1 GP41 TRIMERIC CORE
Descriptor:HIV-1 ENVELOPE PROTEIN CHIMERA, PROTEIN (TRANSMEMBRANE GLYCOPROTEIN)
Authors:Zhou, G., Ferrer, M., Chopra, R., Strassmaier, T., Weissenhorn, W., Skehel, J.J., Oprian, D., Schreiber, S.L., Harrison, S.C., Wiley, D.C.
Deposit date:2000-07-13
Release date:2000-08-23
Last modified:2017-08-09
Method:X-RAY DIFFRACTION (3 Å)
Cite:The structure of an HIV-1 specific cell entry inhibitor in complex with the HIV-1 gp41 trimeric core.
Bioorg.Med.Chem., 8, 2000
1ZEO
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CRYSTAL STRUCTURE OF HUMAN PPAR-GAMMA LIGAND BINDING DOMAIN COMPLEXED WITH AN ALPHA-ARYLOXYPHENYLACETIC ACID AGONIST
Descriptor:Peroxisome proliferator activated receptor gamma, (2S)-(4-ISOPROPYLPHENYL)[(2-METHYL-3-OXO-5,7-DIPROPYL-2,3-DIHYDRO-1,2-BENZISOXAZOL-6-YL)OXY]ACETATE
Authors:Shi, G.Q., Dropinski, J.F., McKeever, B.M., Adams, A.D., MacNaul, K.L., Elbrecht, A., Berger, J.P., Zhou, G., Doebber, T.W.
Deposit date:2005-04-19
Release date:2006-04-25
Last modified:2018-01-24
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Design and Synthesis of alpha-Aryloxyphenylacetic Acid Derivatives: A Novel Class of PPAR alpha/gamma Dual Agonists with Potent Antihyperglycemic and Lipid Modulating Activity
J.Med.Chem., 48, 2005
3EDZ
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CRYSTAL STRUCTURE OF CATALYTIC DOMAIN OF TACE WITH HYDROXAMATE INHIBITOR
Descriptor:ADAM 17, ZINC ION, N-{(2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl}-3-methyl-L-valyl-N-(2-aminoethyl)-L-alaninamide, ...
Authors:Mazzola, R.D., Zhu, Z., Sinning, L., McKittrick, B., Lavey, B., Spitler, J., Kozlowski, J., Neng-Yang, S., Zhou, G., Guo, Z., Orth, P., Madison, V., Sun, J., Lundell, D., Niu, X.
Deposit date:2008-09-03
Release date:2008-09-23
Last modified:2013-02-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Discovery of novel hydroxamates as highly potent tumor necrosis factor-alpha converting enzyme inhibitors. Part II: optimization of the S3' pocket.
Bioorg.Med.Chem.Lett., 18, 2008
4E26
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BRAF IN COMPLEX WITH AN ORGANIC INHIBITOR 7898734
Descriptor:Serine/threonine-protein kinase B-raf, 5-chloro-7-[(R)-furan-2-yl(pyridin-2-ylamino)methyl]quinolin-8-ol
Authors:Qin, J., Xie, P., Ventocilla, C., Zhou, G., Vultur, A., Chen, Q., Herlyn, M., Winkler, J., Marmorstein, R.
Deposit date:2012-03-07
Release date:2012-05-09
Last modified:2013-01-09
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Identification of a Novel Family of BRAF(V600E) Inhibitors.
J.Med.Chem., 55, 2012
1D41
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STABILIZATION OF Z-DNA BY DEMETHYLATION OF THYMINE BASES: 1.3 ANGSTROMS SINGLE-CRYSTAL STRUCTURE OF D(M5CGUAM5CG)
Descriptor:DNA (5'-D(*(5CM)P*GP*UP*AP*(5CM)P*G)-3'), MAGNESIUM ION
Authors:Zhou, G., Ho, P.S.
Deposit date:1991-05-07
Release date:1992-04-15
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Stabilization of Z-DNA by demethylation of thymine bases: 1.3-A single-crystal structure of d(m5CGUAm5CG).
Biochemistry, 29, 1990
6A69
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CRYO-EM STRUCTURE OF A P-TYPE ATPASE
Descriptor:Plasma membrane calcium-transporting ATPase 1, Neuroplastin, N-ACETYL-D-GLUCOSAMINE
Authors:Gong, D.S., Chi, X.M., Ren, K., Huang, G.X.Y., Zhou, G.W., Yan, N., Lei, J.L., Zhou, Q.
Deposit date:2018-06-27
Release date:2018-09-19
Method:ELECTRON MICROSCOPY (4.11 Å)
Cite:Structure of the human plasma membrane Ca2+-ATPase 1 in complex with its obligatory subunit neuroplastin.
Nat Commun, 9, 2018
6JG3
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CRYO-EM STRUCTURE OF RYR2 (CA2+ ALONE DATASET)
Descriptor:Ryanodine receptor 2, ZINC ION
Authors:Chi, X.M., Gong, D.S., Ren, K., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Zhou, Q., Yan, N.
Deposit date:2019-02-13
Release date:2019-12-11
Last modified:2020-01-01
Method:ELECTRON MICROSCOPY (6.1 Å)
Cite:Molecular basis for allosteric regulation of the type 2 ryanodine receptor channel gating by key modulators.
Proc.Natl.Acad.Sci.USA, 116, 2019
6JGZ
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STRUCTURE OF RYR2 (F/P/CA2+ DATASET)
Descriptor:Peptidyl-prolyl cis-trans isomerase FKBP1B, RyR2, ZINC ION
Authors:Chi, X.M., Gong, D.S., Ren, K., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Zhou, Q., Yan, N.
Deposit date:2019-02-16
Release date:2019-12-11
Last modified:2020-01-01
Method:ELECTRON MICROSCOPY (4.6 Å)
Cite:Molecular basis for allosteric regulation of the type 2 ryanodine receptor channel gating by key modulators.
Proc.Natl.Acad.Sci.USA, 116, 2019
6JH6
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STRUCTURE OF RYR2 (F/A/CA2+ DATASET)
Descriptor:Peptidyl-prolyl cis-trans isomerase FKBP1B, RyR2, ADENOSINE-5'-TRIPHOSPHATE, ...
Authors:Chi, X.M., Gong, D.S., Ren, K., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Zhou, Q., Yan, N.
Deposit date:2019-02-17
Release date:2019-12-11
Last modified:2020-01-01
Method:ELECTRON MICROSCOPY (4.8 Å)
Cite:Molecular basis for allosteric regulation of the type 2 ryanodine receptor channel gating by key modulators.
Proc.Natl.Acad.Sci.USA, 116, 2019
6JHN
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STRUCTURE OF RYR2 (F/C/CA2+ DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, ZINC ION, ...
Authors:Chi, X.M., Gong, D.S., Ren, K., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Zhou, Q., Yan, N.
Deposit date:2019-02-18
Release date:2019-12-11
Last modified:2020-01-01
Method:ELECTRON MICROSCOPY (4.5 Å)
Cite:Molecular basis for allosteric regulation of the type 2 ryanodine receptor channel gating by key modulators.
Proc.Natl.Acad.Sci.USA, 116, 2019
6JI0
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STRUCTURE OF RYR2 (F/A/C/CA2+ DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, ZINC ION, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-02-19
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JI8
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STRUCTURE OF RYR2 (F/APOCAM DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, Calmodulin-1, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-02-20
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (3.6 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JII
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STRUCTURE OF RYR2 (F/A/C/L-CA2+/APO-CAM-M DATASET)
Descriptor:Peptidyl-prolyl cis-trans isomerase FKBP1B, Ryr2, Calmodulin-1, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-02-21
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JIU
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STRUCTURE OF RYR2 (F/A/C/L-CA2+/CA2+CAM DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, Calmodulin-1, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-02-23
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (4.2 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JIY
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STRUCTURE OF RYR2 (F/A/C/H-CA2+/CA2+CAM DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, Calmodulin-1, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-02-24
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JRR
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STRUCTURE OF RYR2 (*F/A/C/L-CA2+ DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, ZINC ION, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-04-05
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (3.9 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JRS
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STRUCTURE OF RYR2 (*F/A/C/L-CA2+/CA2+-CAM DATASET)
Descriptor:RyR2, Peptidyl-prolyl cis-trans isomerase FKBP1B, Calmodulin-1, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-04-05
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (3.7 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
6JV2
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STRUCTURE OF RYR2 (P/L-CA2+/CA2+-CAM DATASET)
Descriptor:RyR2, Calmodulin-1, ZINC ION, ...
Authors:Gong, D.S., Chi, X.M., Zhou, G.W., Huang, G.X.Y., Lei, J.L., Yan, N.
Deposit date:2019-04-15
Release date:2019-07-17
Last modified:2019-11-06
Method:ELECTRON MICROSCOPY (4.4 Å)
Cite:Modulation of cardiac ryanodine receptor 2 by calmodulin.
Nature, 572, 2019
1M15
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TRANSITION STATE STRUCTURE OF ARGININE KINASE
Descriptor:arginine kinase, NITRATE ION, MAGNESIUM ION, ...
Authors:Yousef, M.S., Fabiola, F., Gattis, J.L., Somasundaram, T., Chapman, M.S.
Deposit date:2002-06-17
Release date:2002-12-04
Last modified:2019-07-24
Method:X-RAY DIFFRACTION (1.2 Å)
Cite:Refinement of the arginine kinase transition-state analogue complex at 1.2 A resolution: mechanistic insights.
Acta Crystallogr.,Sect.D, 58, 2002
3TY0
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STRUCTURE OF PPARGAMMA LIGAND BINDING DOMAIN IN COMPLEX WITH (R)-5-(3-((3-(6-METHOXYBENZO[D]ISOXAZOL-3-YL)-2-OXO-2,3-DIHYDRO-1H-BENZO[D]IMIDAZOL-1-YL)METHYL)PHENYL)-5-METHYLOXAZOLIDINE-2,4-DIONE
Descriptor:Peroxisome proliferator-activated receptor gamma, (5R)-5-(3-{[3-(6-methoxy-1,2-benzoxazol-3-yl)-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl]methyl}phenyl)-5-methyl-1,3-oxazolidine-2,4-dione
Authors:Soisson, S.M., Meinke, P.M., McKeever, B., Liu, W.
Deposit date:2011-09-23
Release date:2011-11-23
Last modified:2017-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Benzimidazolones: a new class of selective peroxisome proliferator-activated receptor gamma (PPAR-gamma) modulators.
J.Med.Chem., 54, 2011
1VHR
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HUMAN VH1-RELATED DUAL-SPECIFICITY PHOSPHATASE
Descriptor:HUMAN VH1-RELATED DUAL-SPECIFICITY PHOSPHATASE VHR, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, SULFATE ION
Authors:Yuvaniyama, J., Denu, J.M., Dixon, J.E., Saper, M.A.
Deposit date:1996-02-20
Release date:1996-06-20
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal structure of the dual specificity protein phosphatase VHR.
Science, 272, 1996
3E8R
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CRYSTAL STRUCTURE OF CATALYTIC DOMAIN OF TACE WITH HYDROXAMATE INHIBITOR
Descriptor:ADAM 17, ZINC ION, (1R,2S)-N~2~-hydroxy-1-{4-[(2-phenylquinolin-4-yl)methoxy]benzyl}cyclopropane-1,2-dicarboxamide, ...
Authors:Orth, P.
Deposit date:2008-08-20
Release date:2008-10-21
Last modified:2013-02-27
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Discovery of novel hydroxamates as highly potent tumor necrosis factor-alpha converting enzyme inhibitors. Part II: optimization of the S3' pocket.
Bioorg.Med.Chem.Lett., 18, 2008
3KMC
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CRYSTAL STRUCTURE OF CATALYTIC DOMAIN OF TACE WITH TARTRATE-BASED INHIBITOR
Descriptor:TNF-alpha-converting enzyme, ZINC ION, N-{(2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl}-3-methyl-L-valyl-N-(2-aminoethyl)-L-alaninamide, ...
Authors:Orth, P.
Deposit date:2009-11-10
Release date:2009-12-22
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The discovery of novel tartrate-based TNF-alpha converting enzyme (TACE) inhibitors.
Bioorg.Med.Chem.Lett., 20, 2009
3KME
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CRYSTAL STRUCTURE OF CATALYTIC DOMAIN OF TACE WITH PHENYL-PYRROLIDINYL-TARTRATE INHIBITOR
Descriptor:TNF-alpha-converting enzyme, ZINC ION, N-{(2R)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl}-3-methyl-L-valyl-N-(2-aminoethyl)-L-alaninamide, ...
Authors:Orth, P.
Deposit date:2009-11-10
Release date:2009-12-22
Last modified:2013-02-27
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:The discovery of novel tartrate-based TNF-alpha converting enzyme (TACE) inhibitors.
Bioorg.Med.Chem.Lett., 20, 2009
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