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1WL3
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BU of 1wl3 by Molmil
Crystal Structure Of Octaprenyl Pyrophosphate Synthase From Hyperthermophilic Thermotoga Maritima R91A mutant
Descriptor: octoprenyl-diphosphate synthase
Authors:Guo, R.T, Kuo, C.J, Cheng, Y.S, Cheng, Y.L, Liang, P.H, Wang, A.H.-J.
Deposit date:2004-06-18
Release date:2005-06-28
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (3.5 Å)
Cite:Biochemical and Structural Basis for Octaprenyl Pyrophosphate Synthase
To be Published
1WKZ
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BU of 1wkz by Molmil
Crystal Structure Of Octaprenyl Pyrophosphate Synthase From Hyperthermophilic Thermotoga Maritima K41A mutant
Descriptor: SULFATE ION, octoprenyl-diphosphate synthase
Authors:Guo, R.T, Kuo, C.J, Cheng, Y.S, Cheng, Y.L, Liang, P.H, Wang, A.H.-J.
Deposit date:2004-06-18
Release date:2005-06-28
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Biochemical and Structural Basis for Octaprenyl Pyrophosphate Synthase
To be Published
7C8T
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BU of 7c8t by Molmil
Complex Structure of SARS-CoV-2 3CL Protease with TG-0205221
Descriptor: 3C-like proteinase, N-[(BENZYLOXY)CARBONYL]-O-(TERT-BUTYL)-L-THREONYL-3-CYCLOHEXYL-N-[(1S)-2-HYDROXY-1-{[(3S)-2-OXOPYRROLIDIN-3-YL]METHYL}ETHYL]-L-ALANINAMIDE
Authors:Lee, C.C, Wang, A.H.J, Kuo, C.J, Liang, P.H.
Deposit date:2020-06-03
Release date:2020-06-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Complex Structures and Cellular Activities of the Potent SARS-CoV-2 3CLpro Inhibitors Guiding Drug Discovery Against COVID-19
To Be Published
7C8R
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BU of 7c8r by Molmil
Complex Structure of SARS-CoV-2 3CL Protease with TG-0203770
Descriptor: 3C-like proteinase, ethyl (4R)-4-[[(2S)-4-methyl-2-[[(2S,3R)-3-[(2-methylpropan-2-yl)oxy]-2-(phenylmethoxycarbonylamino)butanoyl]amino]pentanoyl]amino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pentanoate
Authors:Lee, C.C, Wang, A.H.J, Kuo, C.J, Liang, P.H.
Deposit date:2020-06-03
Release date:2020-06-17
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Complex Structures and Cellular Activities of the Potent SARS-CoV-2 3CLpro Inhibitors Guiding Drug Discovery Against COVID-19
To Be Published
1C9D
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BU of 1c9d by Molmil
CRYSTAL STRUCTURE OF THE COMPLEX OF BACTERIAL TRYPTOPHAN SYNTHASE WITH THE TRANSITION STATE ANALOGUE INHIBITOR 4-(2-HYDROXY-4-FLUOROPHENYLTHIO)-BUTYLPHOSPHONIC ACID
Descriptor: 4-(2-HYDROXY-4-FLUOROPHENYLTHIO)-BUTYLPHOSPHONIC ACID, PYRIDOXAL-5'-PHOSPHATE, SODIUM ION, ...
Authors:Lolis, E, Sachpatzidis, A.
Deposit date:1999-08-02
Release date:1999-12-29
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Crystallographic studies of phosphonate-based alpha-reaction transition-state analogues complexed to tryptophan synthase.
Biochemistry, 38, 1999
2WSY
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BU of 2wsy by Molmil
CRYSTAL STRUCTURE OF WILD-TYPE TRYPTOPHAN SYNTHASE
Descriptor: PYRIDOXAL-5'-PHOSPHATE, SODIUM ION, TRYPTOPHAN SYNTHASE
Authors:Schneider, T.R, Gerhardt, E, Lee, M, Liang, P.-H, Anderson, K.S, Schlichting, I.
Deposit date:1998-02-18
Release date:1999-03-30
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (3.05 Å)
Cite:Loop closure and intersubunit communication in tryptophan synthase.
Biochemistry, 37, 1998
1A50
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BU of 1a50 by Molmil
CRYSTAL STRUCTURE OF WILD-TYPE TRYPTOPHAN SYNTHASE COMPLEXED WITH 5-FLUOROINDOLE PROPANOL PHOSPHATE
Descriptor: 5-FLUOROINDOLE PROPANOL PHOSPHATE, PYRIDOXAL-5'-PHOSPHATE, SODIUM ION, ...
Authors:Schneider, T.R, Gerhardt, E, Lee, M, Liang, P.-H, Anderson, K.S, Schlichting, I.
Deposit date:1998-02-18
Release date:1999-03-30
Last modified:2023-08-02
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Loop closure and intersubunit communication in tryptophan synthase.
Biochemistry, 37, 1998
1A5S
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BU of 1a5s by Molmil
CRYSTAL STRUCTURE OF WILD-TYPE TRYPTOPHAN SYNTHASE COMPLEXED WITH 5-FLUOROINDOLE PROPANOL PHOSPHATE AND L-SER BOUND AS AMINO ACRYLATE TO THE BETA SITE
Descriptor: 5-FLUOROINDOLE PROPANOL PHOSPHATE, PYRIDOXAL-5'-PHOSPHATE, SERINE, ...
Authors:Schneider, T.R, Gerhardt, E, Lee, M, Liang, P.-H, Anderson, K.S, Schlichting, I.
Deposit date:1998-02-17
Release date:1999-03-30
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Loop closure and intersubunit communication in tryptophan synthase.
Biochemistry, 37, 1998
4XWN
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BU of 4xwn by Molmil
Complex structure of catalytic domain of Clostridium Cellulovorans Exgs and Cellotetraose
Descriptor: CALCIUM ION, Exoglucanase S, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose, ...
Authors:Liaw, Y.-C.
Deposit date:2015-01-29
Release date:2015-10-28
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.884 Å)
Cite:Structures of exoglucanase from Clostridium cellulovorans: cellotetraose binding and cleavage
Acta Crystallogr.,Sect.F, 71, 2015
4XWL
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BU of 4xwl by Molmil
Catalytic domain of Clostridium Cellulovorans Exgs
Descriptor: 1,2-ETHANEDIOL, 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, CALCIUM ION, ...
Authors:liaw, Y.-C.
Deposit date:2015-01-29
Release date:2015-10-28
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.051 Å)
Cite:Structures of exoglucanase from Clostridium cellulovorans: cellotetraose binding and cleavage
Acta Crystallogr.,Sect.F, 71, 2015
4XWM
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BU of 4xwm by Molmil
Complex structure of catalytic domain of Clostridium Cellulovorans Exgs and Cellobiose
Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, Exoglucanase S, ...
Authors:Liaw, Y.-C.
Deposit date:2015-01-29
Release date:2015-10-28
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.703 Å)
Cite:Structures of exoglucanase from Clostridium cellulovorans: cellotetraose binding and cleavage
Acta Crystallogr.,Sect.F, 71, 2015
1PT3
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BU of 1pt3 by Molmil
Crystal structures of nuclease-ColE7 complexed with octamer DNA
Descriptor: 5'-GCGATCGC-3', Colicin E7
Authors:Hsia, K.C, Chak, K.F, Cheng, Y.S, Ku, W.Y, Yuan, H.S.
Deposit date:2003-06-22
Release date:2004-03-30
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:DNA binding and degradation by the HNH protein ColE7.
STRUCTURE, 12, 2004
2GZ8
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BU of 2gz8 by Molmil
Structure-Based Drug Design and Structural Biology Study of Novel Nonpeptide Inhibitors of SARS-CoV Main Protease
Descriptor: Replicase polyprotein 1ab, S-[5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL] 5-(PHENYLETHYNYL)FURAN-2-CARBOTHIOATE
Authors:Lu, I.L, Wu, S.Y.
Deposit date:2006-05-11
Release date:2006-08-29
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Structure-Based Drug Design and Structural Biology Study of Novel Nonpeptide Inhibitors of Severe Acute Respiratory Syndrome Coronavirus Main Protease
J.Med.Chem., 49, 2006
2GZ9
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BU of 2gz9 by Molmil
Structure-Based Drug Design and Structural Biology Study of Novel Nonpeptide Inhibitors of SARS-CoV Main Protease
Descriptor: Replicase polyprotein 1ab
Authors:Lu, I.L, Wu, S.Y.
Deposit date:2006-05-11
Release date:2006-08-29
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.17 Å)
Cite:Structure-Based Drug Design and Structural Biology Study of Novel Nonpeptide Inhibitors of Severe Acute Respiratory Syndrome Coronavirus Main Protease
J.Med.Chem., 49, 2006
2GZ7
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BU of 2gz7 by Molmil
Structure-Based Drug Design and Structural Biology Study of Novel Nonpeptide Inhibitors of SARS-CoV Main Protease
Descriptor: 2-[(2,4-DICHLORO-5-METHYLPHENYL)SULFONYL]-1,3-DINITRO-5-(TRIFLUOROMETHYL)BENZENE, Replicase polyprotein 1ab
Authors:Lu, I.L, Wu, S.Y.
Deposit date:2006-05-11
Release date:2006-08-29
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.856 Å)
Cite:Structure-Based Drug Design and Structural Biology Study of Novel Nonpeptide Inhibitors of Severe Acute Respiratory Syndrome Coronavirus Main Protease
J.Med.Chem., 49, 2006
4U5I
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BU of 4u5i by Molmil
Complex structure of mutant CtCel5E (E314A) with xylobiose
Descriptor: Endoglucanase H, beta-D-xylopyranose-(1-4)-beta-D-xylopyranose
Authors:Guo, R.T, Huang, C.H, Wu, T.H.
Deposit date:2014-07-25
Release date:2015-01-14
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Biochemical Characterization and Structural Analysis of a Bifunctional Cellulase/Xylanase from Clostridium thermocellum
J.Biol.Chem., 290, 2015
4U5K
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BU of 4u5k by Molmil
Complex structure of mutant CtCel5E (E314A) with cellobiose
Descriptor: Endoglucanase H, beta-D-glucopyranose-(1-4)-beta-D-glucopyranose
Authors:Guo, R.T, Huang, C.H, Wu, T.H.
Deposit date:2014-07-25
Release date:2015-01-14
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Biochemical Characterization and Structural Analysis of a Bifunctional Cellulase/Xylanase from Clostridium thermocellum
J.Biol.Chem., 290, 2015
2Z9L
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BU of 2z9l by Molmil
complex structure of SARS-CoV 3C-like protease with JMF1586
Descriptor: 3C-like proteinase, DIMETHYL SULFOXIDE, diaminozinc
Authors:Lee, C.C, Wang, A.H.
Deposit date:2007-09-20
Release date:2007-12-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors.
Febs Lett., 581, 2007
2Z9G
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BU of 2z9g by Molmil
Complex structure of SARS-CoV 3C-like protease with PMA
Descriptor: 3C-like proteinase, BENZENE, MERCURY (II) ION
Authors:Lee, C.C, Wang, A.H.
Deposit date:2007-09-19
Release date:2007-12-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.86 Å)
Cite:Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors.
Febs Lett., 581, 2007
2Z94
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BU of 2z94 by Molmil
Complex structure of SARS-CoV 3C-like protease with TDT
Descriptor: 4-methylbenzene-1,2-dithiol, Replicase polyprotein 1ab, ZINC ION
Authors:Lee, C.C, Wang, A.H.
Deposit date:2007-09-17
Release date:2007-12-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.78 Å)
Cite:Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors
Febs Lett., 581, 2007
2Z9K
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BU of 2z9k by Molmil
Complex structure of SARS-CoV 3C-like protease with JMF1600
Descriptor: (dimethylamino)(hydroxy)zinc', 3C-like proteinase, DIMETHYL SULFOXIDE
Authors:Lee, C.C, Wang, A.H.
Deposit date:2007-09-20
Release date:2007-12-25
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structural basis of mercury- and zinc-conjugated complexes as SARS-CoV 3C-like protease inhibitors.
Febs Lett., 581, 2007
2ZU1
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BU of 2zu1 by Molmil
crystal structure of CVB3 3C protease mutant C147A
Descriptor: 3C proteinase
Authors:Lee, C.C, Tsui, Y.C, Wang, A.H.-J.
Deposit date:2008-10-12
Release date:2009-01-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.38 Å)
Cite:Structural Basis of Inhibition Specificities of 3C and 3C-like Proteases by Zinc-coordinating and Peptidomimetic Compounds
J.Biol.Chem., 284, 2009
2ZU5
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BU of 2zu5 by Molmil
complex structure of SARS-CoV 3CL protease with TG-0205486
Descriptor: 3C-like proteinase, N-[(benzyloxy)carbonyl]-O-tert-butyl-L-threonyl-N-[(1R)-4-cyclopropyl-4-oxo-1-{[(3S)-2-oxopyrrolidin-3-yl]methyl}butyl]-L-leucinamide
Authors:Hsu, M.F, Lee, C.C, Wang, A.H.-J.
Deposit date:2008-10-12
Release date:2009-01-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Structural Basis of Inhibition Specificities of 3C and 3C-like Proteases by Zinc-coordinating and Peptidomimetic Compounds
J.Biol.Chem., 284, 2009
2ZU2
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BU of 2zu2 by Molmil
complex structure of CoV 229E 3CL protease with EPDTC
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 3C-like proteinase, zinc(II)hydrogensulfide
Authors:Lee, C.C, Wang, A.H.-J.
Deposit date:2008-10-12
Release date:2009-01-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural Basis of Inhibition Specificities of 3C and 3C-like Proteases by Zinc-coordinating and Peptidomimetic Compounds
J.Biol.Chem., 284, 2009
2ZTY
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crystal structure of 3C protease from CVB3 in space group C2
Descriptor: 3C proteinase
Authors:Lee, C.C, Wang, A.H.-J.
Deposit date:2008-10-10
Release date:2009-01-13
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Structural Basis of Inhibition Specificities of 3C and 3C-like Proteases by Zinc-coordinating and Peptidomimetic Compounds
J.Biol.Chem., 284, 2009

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