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1COI
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BU of 1coi by Molmil
DESIGNED TRIMERIC COILED COIL-VALD
Descriptor: COIL-VALD, SULFATE ION
Authors:Ogihara, N.L, Weiss, M.S, Degrado, W.F, Eisenberg, D.
Deposit date:1996-08-10
Release date:1997-02-12
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The crystal structure of the designed trimeric coiled coil coil-VaLd: implications for engineering crystals and supramolecular assemblies.
Protein Sci., 6, 1997
7YD4
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BU of 7yd4 by Molmil
Crystal structure of an N terminal truncated secreted protein, Rv0398c from Mycobacterium tuberculosis
Descriptor: GLYCEROL, Possible secreted protein
Authors:Saha, R, Mukherjee, S, Singh, B.K, Weiss, M.S, De, S, Das, A.K.
Deposit date:2022-07-03
Release date:2023-06-28
Method:X-RAY DIFFRACTION (1.896 Å)
Cite:Crystal structure of a mycobacterial secretory protein Rv0398c and in silico prediction of its export pathway
Biochem.Biophys.Res.Commun., 672, 2023
3TZ6
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BU of 3tz6 by Molmil
Crystal structure of Aspartate semialdehyde dehydrogenase Complexed With inhibitor SMCS (CYS) And Phosphate From Mycobacterium tuberculosis H37Rv
Descriptor: Aspartate-semialdehyde dehydrogenase, CYSTEINE, GLYCEROL, ...
Authors:Vyas, R, Tewari, R, Weiss, M.S, Karthikeyan, S.
Deposit date:2011-09-27
Release date:2012-05-30
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Structures of ternary complexes of aspartate-semialdehyde dehydrogenase (Rv3708c) from Mycobacterium tuberculosis H37Rv
Acta Crystallogr.,Sect.D, 68, 2012
3VOS
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BU of 3vos by Molmil
Crystal structure of Aspartate semialdehyde dehydrogenase Complexed With glycerol and sulfate From Mycobacterium tuberculosis H37Rv
Descriptor: Aspartate-semialdehyde dehydrogenase, GLYCEROL, SULFATE ION
Authors:Vyas, R, Tewari, R, Weiss, M.S, Karthikeyan, S.
Deposit date:2012-02-07
Release date:2012-05-30
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.18 Å)
Cite:Structures of ternary complexes of aspartate-semialdehyde dehydrogenase (Rv3708c) from Mycobacterium tuberculosis H37Rv
Acta Crystallogr.,Sect.D, 68, 2012
1YL7
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BU of 1yl7 by Molmil
the crystal structure of Mycobacterium tuberculosis dihydrodipicolinate reductase (Rv2773c) in complex with NADH (crystal form C)
Descriptor: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, Dihydrodipicolinate reductase, MAGNESIUM ION
Authors:Janowski, R, Kefala, G, Weiss, M.S, TB Structural Genomics Consortium (TBSGC)
Deposit date:2005-01-19
Release date:2006-01-17
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.34 Å)
Cite:The structure of dihydrodipicolinate reductase (DapB) from Mycobacterium tuberculosis in three crystal forms.
Acta Crystallogr.,Sect.D, 66, 2010
1ZEL
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BU of 1zel by Molmil
Crystal structure of RV2827C protein from Mycobacterium tuberculosis
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, ACETATE ION, FORMIC ACID, ...
Authors:Janowski, R, Panjikar, S, Mueller-dieckmann, J, Weiss, M.S, TB Structural Genomics Consortium (TBSGC)
Deposit date:2005-04-19
Release date:2006-05-02
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.93 Å)
Cite:Structural analysis reveals DNA binding properties of Rv2827c, a hypothetical protein from Mycobacterium tuberculosis.
J Struct Funct Genomics, 10, 2009
6Y08
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BU of 6y08 by Molmil
Mouse thymidylate synthase cocrystallized with dUMP and soaked in sulfamethoxazole
Descriptor: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, Sulfamethoxazole, Thymidylate synthase
Authors:Maj, P, Jarmula, A, Wilk, P, Weiss, M.S, Rode, W.
Deposit date:2020-02-06
Release date:2021-02-17
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.297 Å)
Cite:Mouse thymidylate synthase cocrystallized with dUMP and soaked in sulfamethoxazole
To Be Published
2A7A
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BU of 2a7a by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: CALCIUM ION, Concanavalin A, MANGANESE (II) ION, ...
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7J
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BU of 2a7j by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: ACETATE ION, CALCIUM ION, CHLORIDE ION, ...
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A5W
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BU of 2a5w by Molmil
Crystal structure of the oxidized gamma-subunit of the dissimilatory sulfite reductase (DsrC) from Archaeoglobus fulgidus
Descriptor: SULFATE ION, sulfite reductase, desulfoviridin-type subunit gamma (dsvC)
Authors:Mander, G.J, Weiss, M.S, Hedderich, R, Kahnt, J, Ermler, U, Warkentin, E.
Deposit date:2005-07-01
Release date:2005-09-06
Last modified:2023-08-23
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:X-ray structure of the gamma-subunit of a dissimilatory sulfite reductase: Fixed and flexible C-terminal arms.
Febs Lett., 579, 2005
2A7C
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BU of 2a7c by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: Elastase 1, GLYCEROL, SULFATE ION, ...
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7E
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BU of 2a7e by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: DNA (5'-D(*CP*CP*CP*TP*AP*GP*GP*G)-3')
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7F
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BU of 2a7f by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: CHLORIDE ION, Lysozyme C, SODIUM ION
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7D
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BU of 2a7d by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: CHLORIDE ION, Lysozyme C, SODIUM ION, ...
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7G
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BU of 2a7g by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: ACETIC ACID, CALCIUM ION, DIMETHYL SULFOXIDE, ...
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7B
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BU of 2a7b by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: XENON, gamma-adaptin appendage domain
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7I
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BU of 2a7i by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: L(+)-TARTARIC ACID, Thaumatin I
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2A7H
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BU of 2a7h by Molmil
On the Routine Use of Soft X-Rays in Macromolecular Crystallography, Part III- The Optimal Data Collection Wavelength
Descriptor: CALCIUM ION, CHLORIDE ION, Cationic trypsin
Authors:Mueller-Dieckmann, C, Panjikar, S, Tucker, P.A, Weiss, M.S.
Deposit date:2005-07-05
Release date:2005-07-19
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:On the routine use of soft X-rays in macromolecular crystallography. Part III. The optimal data-collection wavelength.
Acta Crystallogr.,Sect.D, 61, 2005
2Q27
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BU of 2q27 by Molmil
Crystal structure of oxalyl-coA decarboxylase from Escherichia coli
Descriptor: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, MAGNESIUM ION, ...
Authors:Werther, T, Zimmer, A, Wille, G, Hubner, G, Weiss, M.S, Konig, S.
Deposit date:2007-05-26
Release date:2008-06-03
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.12 Å)
Cite:New insights into structure-function relationships of oxalyl CoA decarboxylase from Escherichia coli.
Febs J., 277, 2010
2Q29
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BU of 2q29 by Molmil
Crystal structure of oxalyl-coA decarboxylase from Escherichia coli in complex with acetyl coenzyme A
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ACETYL COENZYME *A, MAGNESIUM ION, ...
Authors:Werther, T, Zimmer, A, Wille, G, Hubner, G, Weiss, M.S, Konig, S.
Deposit date:2007-05-26
Release date:2008-06-03
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:New insights into structure-function relationships of oxalyl CoA decarboxylase from Escherichia coli.
Febs J., 277, 2010
2Q28
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BU of 2q28 by Molmil
Crystal structure of oxalyl-coA decarboxylase from Escherichia coli in complex with adenosine-5`-diphosphate
Descriptor: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ADENOSINE-5'-DIPHOSPHATE, ...
Authors:Werther, T, Zimmer, A, Wille, G, Hubner, G, Weiss, M.S, Konig, S.
Deposit date:2007-05-26
Release date:2008-06-03
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:New insights into structure-function relationships of oxalyl CoA decarboxylase from Escherichia coli.
Febs J., 277, 2010
2R8P
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BU of 2r8p by Molmil
Transketolase from E. coli in complex with substrate D-fructose-6-phosphate
Descriptor: 1,2-ETHANEDIOL, 2-C-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thiazol-3-ium-2-yl}-6-O-phosphono-D-glucitol, CALCIUM ION, ...
Authors:Wille, G, Asztalos, P, Weiss, M.S, Tittmann, K.
Deposit date:2007-09-11
Release date:2007-12-11
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:Strain and near attack conformers in enzymic thiamin catalysis: X-ray crystallographic snapshots of bacterial transketolase in covalent complex with donor ketoses xylulose 5-phosphate and fructose 6-phosphate, and in noncovalent complex with acceptor aldose ribose 5-phosphate.
Biochemistry, 46, 2007
2R8O
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BU of 2r8o by Molmil
Transketolase from E. coli in complex with substrate D-xylulose-5-phosphate
Descriptor: 1,2-ETHANEDIOL, 2-C-{3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-5-(2-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}ethyl)-4-methyl-1,3-thia zol-3-ium-2-yl}-5-O-phosphono-D-xylitol, CALCIUM ION, ...
Authors:Wille, G, Asztalos, P, Weiss, M.S, Tittmann, K.
Deposit date:2007-09-11
Release date:2007-12-11
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Strain and near attack conformers in enzymic thiamin catalysis: X-ray crystallographic snapshots of bacterial transketolase in covalent complex with donor ketoses xylulose 5-phosphate and fructose 6-phosphate, and in noncovalent complex with acceptor aldose ribose 5-phosphate.
Biochemistry, 46, 2007
8PH4
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BU of 8ph4 by Molmil
Co-Crystal structure of the SARS-CoV2 main protease Nsp5 with an Uracil-carrying X77-like inhibitor
Descriptor: 3C-like proteinase nsp5, DIMETHYL SULFOXIDE, MALONATE ION, ...
Authors:Barthel, T, Altincekic, N, Jores, N, Wollenhaupt, J, Weiss, M.S, Schwalbe, H.
Deposit date:2023-06-18
Release date:2024-01-31
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Targeting the Main Protease (M pro , nsp5) by Growth of Fragment Scaffolds Exploiting Structure-Based Methodologies.
Acs Chem.Biol., 19, 2024
4F7I
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BU of 4f7i by Molmil
Structure of Isopropylmalate dehydrogenase from Thermus thermophilus in complex with IPM, Mn and NADH
Descriptor: 3-ISOPROPYLMALIC ACID, 3-isopropylmalate dehydrogenase, 3[N-MORPHOLINO]PROPANE SULFONIC ACID, ...
Authors:Pallo, A, Graczer, E, Zavodszky, P, Weiss, M.S, Vas, M.
Deposit date:2012-05-16
Release date:2012-06-13
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural and energetic basis of isopropylmalate dehydrogenase enzyme catalysis.
Febs J., 281, 2014

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