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7M3H
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BU of 7m3h by Molmil
Targeting Enterococcus faecalis HMG-CoA reductase with a novel non-statin inhibitor
Descriptor: 5-[(4-butylphenyl)sulfamoyl]-2-hydroxybenzoic acid, CALCIUM ION, Hydroxymethylglutaryl-CoA reductase, ...
Authors:Bose, S, Steussy, C.N, Stauffacher, C.V.
Deposit date:2021-03-18
Release date:2022-09-21
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.27 Å)
Cite:Targeting Enterococcus faecalis HMG-CoA reductase with a novel non-statin inhibitor
To Be Published
7M1Z
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BU of 7m1z by Molmil
Targeting Enterococcus faecalis HMG-CoA reductase with a novel non-statin inhibitor
Descriptor: (R)-MEVALONATE, 3-HYDROXY-3-METHYLGLUTARYL-COENZYME A, ACETATE ION, ...
Authors:Bose, S, Steussy, C.N, Stauffacher, C.V.
Deposit date:2021-03-15
Release date:2022-09-21
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Targeting Enterococcus faecalis HMG-CoA reductase with a non-statin inhibitor
Nat Commun, 2023
7M66
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BU of 7m66 by Molmil
Targeting Enterococcus faecalis HMG-CoA reductase with a novel non-statin inhibitor
Descriptor: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
Authors:Bose, S, Steussy, C.N.
Deposit date:2021-03-25
Release date:2022-09-28
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Targeting Enterococcus faecalis HMG-CoA reductase with a non-statin inhibitor.
Commun Biol, 6, 2023
3TSI
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BU of 3tsi by Molmil
Structure of the parainfluenza virus 5 (PIV5) hemagglutinin-neuraminidase (HN) stalk domain
Descriptor: Hemagglutinin-neuraminidase
Authors:Bose, S, Welch, B.D, Kors, C.A, Yuan, P, Jardetzky, T.S, Lamb, R.A.
Deposit date:2011-09-13
Release date:2011-10-26
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2.651 Å)
Cite:Structure and mutagenesis of the parainfluenza virus 5 hemagglutinin-neuraminidase stalk domain reveals a four-helix bundle and the role of the stalk in fusion promotion.
J.Virol., 85, 2011
6IFD
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BU of 6ifd by Molmil
Crystal Structure of CMP-N-acetylneuraminate Synthetase from Vibrio cholerae in complex with CDP and Mg2+.
Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, CMP-N-acetylneuraminate Synthetase, ...
Authors:Bose, S, Subramanian, R.
Deposit date:2018-09-19
Release date:2019-07-03
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural and functional characterization of CMP-N-acetylneuraminate synthetase from Vibrio cholerae.
Acta Crystallogr D Struct Biol, 75, 2019
6IFI
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BU of 6ifi by Molmil
Crystal Structure of the Apo form of CMP-N-acetylneuraminate Synthetase from Vibrio cholerae
Descriptor: CALCIUM ION, CMP-N-acetylneuraminate Synthetase
Authors:Bose, S, Subramanian, R.
Deposit date:2018-09-20
Release date:2019-07-03
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural and functional characterization of CMP-N-acetylneuraminate synthetase from Vibrio cholerae.
Acta Crystallogr D Struct Biol, 75, 2019
7E51
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BU of 7e51 by Molmil
Structure of PEP bound Enolase from Mycobacterium tuberculosis
Descriptor: Enolase, MAGNESIUM ION, PHOSPHOENOLPYRUVATE
Authors:Bose, S, Vinothkumar, K.R.
Deposit date:2021-02-16
Release date:2022-02-16
Last modified:2023-11-08
Method:ELECTRON MICROSCOPY (3.23 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
7E4X
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BU of 7e4x by Molmil
Structure of Enolase from Mycobacterium tuberculosis
Descriptor: Enolase
Authors:Bose, S, Vinothkumar, K.R.
Deposit date:2021-02-15
Release date:2022-02-16
Last modified:2023-11-08
Method:ELECTRON MICROSCOPY (3.08 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
6JOV
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BU of 6jov by Molmil
Crystal structure of a hypothetical Fe Superoxide dismutase
Descriptor: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, FE (III) ION, ...
Authors:Bose, S, Purushothaman, S.S, Subramanian, R.
Deposit date:2019-03-23
Release date:2020-01-29
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.941 Å)
Cite:Crystal structure of a hypothetical Fe Superoxide dismutase
To Be Published
7VSR
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BU of 7vsr by Molmil
Structure of McrBC (stalkless mutant)
Descriptor: 5-methylcytosine-specific restriction enzyme B, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ...
Authors:Saikrishnan, K, Adhav, V.A, Bose, S, Kutti R, V.
Deposit date:2021-10-27
Release date:2023-02-15
Last modified:2024-06-26
Method:ELECTRON MICROSCOPY (4.5 Å)
Cite:Structure of McrBC (stalkless mutant)
To Be Published
1FGY
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BU of 1fgy by Molmil
GRP1 PH DOMAIN WITH INS(1,3,4,5)P4
Descriptor: GRP1, INOSITOL-(1,3,4,5)-TETRAKISPHOSPHATE
Authors:Lietzke, S.E, Bose, S, Cronin, T, Klarlund, J, Chawla, A, Czech, M.P, Lambright, D.G.
Deposit date:2000-07-29
Release date:2000-08-23
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural basis of 3-phosphoinositide recognition by pleckstrin homology domains.
Mol.Cell, 6, 2000
1FGZ
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BU of 1fgz by Molmil
GRP1 PH DOMAIN (UNLIGANDED)
Descriptor: GRP1, SULFATE ION
Authors:Lietzke, S.E, Bose, S, Cronin, T, Klarlund, J, Chawla, A, Czech, M.P, Lambright, D.G.
Deposit date:2000-07-29
Release date:2000-08-23
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:Structural basis of 3-phosphoinositide recognition by pleckstrin homology domains.
Mol.Cell, 6, 2000
6LXY
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BU of 6lxy by Molmil
IRAK4 in complex with inhibitor
Descriptor: Interleukin-1 receptor-associated kinase 4, N-[(2R)-2-fluoranyl-3-methyl-3-oxidanyl-butyl]-6-[(6-fluoranylpyrazolo[1,5-a]pyrimidin-5-yl)amino]-4-(propan-2-ylamino)pyridine-3-carboxamide, SULFATE ION
Authors:Ghosh, K, Bose, S.
Deposit date:2020-02-12
Release date:2020-11-25
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Optimization of Nicotinamides as Potent and Selective IRAK4 Inhibitors with Efficacy in a Murine Model of Psoriasis.
Acs Med.Chem.Lett., 11, 2020
4JF7
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BU of 4jf7 by Molmil
Structure of the parainfluenza virus 5 (PIV5) hemagglutinin-neuraminidase (HN) ectodomain
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
Authors:Welch, B.D, Yuan, P, Bose, S, Kors, C.A, Lamb, R.A, Jardetzky, T.S.
Deposit date:2013-02-27
Release date:2013-09-04
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.5018 Å)
Cite:Structure of the Parainfluenza Virus 5 (PIV5) Hemagglutinin-Neuraminidase (HN) Ectodomain.
Plos Pathog., 9, 2013
6JKU
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BU of 6jku by Molmil
Crystal structure of N-acetylglucosamine-6-phosphate deacetylase from Pasteurella Multocida
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, N-acetylglucosamine-6-phosphate deacetylase, ...
Authors:Manjunath, L, Bose, S, Subramanian, R.
Deposit date:2019-03-01
Release date:2020-03-04
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Quaternary variations in the structural assembly of N-acetylglucosamine-6-phosphate deacetylase from Pasteurella multocida.
Proteins, 2020
6VQL
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BU of 6vql by Molmil
CRYSTAL STRUCTURE OF INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4 (IRAK4-WT) COMPLEX WITH A NICOTINAMIDE INHIBITOR
Descriptor: 6-[(1,3-benzothiazol-6-yl)amino]-4-(cyclopropylamino)-N-[(2R)-2-fluoro-3-hydroxy-3-methylbutyl]pyridine-3-carboxamide, Interleukin-1 receptor-associated kinase 4, SULFATE ION
Authors:Sack, J.S.
Deposit date:2020-02-05
Release date:2020-06-24
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.069 Å)
Cite:Optimization of Nicotinamides as Potent and Selective IRAK4 Inhibitors with Efficacy in a Murine Model of Psoriasis.
Acs Med.Chem.Lett., 11, 2020
6L7D
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BU of 6l7d by Molmil
Mycobacterium tuberculosis enolase mutant - S42A
Descriptor: 1,2-ETHANEDIOL, 2-PHOSPHOGLYCERIC ACID, ACETATE ION, ...
Authors:Ahmad, M, Jha, B, Tiwari, S, Dwivedy, A, Biswal, B.K.
Deposit date:2019-11-01
Release date:2020-11-04
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
7CLL
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BU of 7cll by Molmil
Mycobacterium tubeculosis enolase in complex with 2-Phosphoglycerate
Descriptor: 2-PHOSPHOGLYCERIC ACID, ACETATE ION, CHLORIDE ION, ...
Authors:Ahmad, M, Jha, B, Tiwari, S, Pal, R.K, Biswal, B.K.
Deposit date:2020-07-21
Release date:2021-07-28
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
7CLK
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BU of 7clk by Molmil
Mycobacterium tuberculosis enolase in complex with alternate 2-phosphoglycerate
Descriptor: 1,2-ETHANEDIOL, 2-PHOSPHOGLYCERIC ACID, ACETATE ION, ...
Authors:Ahmad, M, Jha, B, Tiwari, S, Pal, R.K, Biswal, B.K.
Deposit date:2020-07-21
Release date:2022-01-26
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
7CKP
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BU of 7ckp by Molmil
Mycobacterium tuberculosis Enolase
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, Enolase, MAGNESIUM ION
Authors:Biswal, B.K, Ahmad, M, Jha, B.
Deposit date:2020-07-18
Release date:2021-07-21
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
7DLR
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BU of 7dlr by Molmil
Mycobacterium tuberculosis enolase mutant - E163A
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, CHLORIDE ION, ...
Authors:Ahmad, M, Biswal, B.K.
Deposit date:2020-11-30
Release date:2021-12-01
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023
7E4F
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BU of 7e4f by Molmil
Mycobacterium tuberculosis enolase mutant - E204A complex with phosphoenolpyruvate
Descriptor: 1,2-ETHANEDIOL, ACETATE ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Ahmad, M, Pal, R.K, Biswal, B.K.
Deposit date:2021-02-11
Release date:2022-02-16
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural snapshots of Mycobacterium tuberculosis enolase reveal dual mode of 2PG binding and its implication in enzyme catalysis.
Iucrj, 10, 2023

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