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8TFO
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BU of 8tfo by Molmil
Structure of MKvar
Descriptor: (R)-MEVALONATE, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ...
Authors:Peat, T.S, Newman, J, Esquirol, L, Nebl, T, Scott, C, Vickers, C, Sainsbury, F.
Deposit date:2023-07-11
Release date:2024-03-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:Characterization of novel mevalonate kinases from the tardigrade Ramazzottius varieornatus and the psychrophilic archaeon Methanococcoides burtonii.
Acta Crystallogr D Struct Biol, 80, 2024
8TEB
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BU of 8teb by Molmil
Structure of MKbur
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, MAGNESIUM ION, ...
Authors:Peat, T.S, Newman, J, Esquirol, L, Nebl, T, Scott, C, Vickers, C, Sainsbury, F.
Deposit date:2023-07-06
Release date:2024-03-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Characterization of novel mevalonate kinases from the tardigrade Ramazzottius varieornatus and the psychrophilic archaeon Methanococcoides burtonii.
Acta Crystallogr D Struct Biol, 80, 2024
6PII
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BU of 6pii by Molmil
The evolving story of AtzT, a periplasmic binding protein
Descriptor: Atrazine periplasmic binding protein, CALCIUM ION, ETHYL MERCURY ION, ...
Authors:Peat, T.S, Newman, J, Scott, C, Esquirol, L, Dennis, M, Nebl, T.
Deposit date:2019-06-26
Release date:2019-11-13
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:The evolving story of AtzT, a periplasmic binding protein.
Acta Crystallogr D Struct Biol, 75, 2019
6PI5
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BU of 6pi5 by Molmil
The evolving story of AtzT, a periplasmic binding protein
Descriptor: Atrazine periplasmic binding protein, DIMETHYL SULFOXIDE, GUANINE
Authors:Peat, T.S, Newman, J, Scott, C, Esquirol, L, Dennis, M, Nebl, T.
Deposit date:2019-06-26
Release date:2019-11-13
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.67 Å)
Cite:The evolving story of AtzT, a periplasmic binding protein.
Acta Crystallogr D Struct Biol, 75, 2019
6PI6
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BU of 6pi6 by Molmil
The evolving story of AtzT, a periplasmic binding protein
Descriptor: 4-(ethylamino)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-ol, Atrazine periplasmic binding protein, DIMETHYL SULFOXIDE
Authors:Peat, T.S, Newman, J, Scott, C, Esquirol, L, Dennis, M, Nebl, T.
Deposit date:2019-06-26
Release date:2019-11-13
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.65 Å)
Cite:The evolving story of AtzT, a periplasmic binding protein.
Acta Crystallogr D Struct Biol, 75, 2019
7RG7
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BU of 7rg7 by Molmil
Crystal structure of nanoclamp8:VHH in complex with MTX
Descriptor: MAGNESIUM ION, METHOTREXATE, nano CLostridial Antibody Mimetic Protein 8 VHH
Authors:Guo, Z, Peat, T, Newman, J, Alexandrov, K.
Deposit date:2021-07-14
Release date:2021-12-22
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Design of a methotrexate-controlled chemical dimerization system and its use in bio-electronic devices.
Nat Commun, 12, 2021
6WEW
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BU of 6wew by Molmil
Crystal structures of human E-NPP 1: bound to N-{4-[(7-methoxyquinolin-4-yl)oxy]phenyl}sulfuric diamide
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Peat, T.S, Dennis, M, Newman, J.
Deposit date:2020-04-03
Release date:2020-09-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.73 Å)
Cite:Crystal structures of human ENPP1 in apo and bound forms.
Acta Crystallogr D Struct Biol, 76, 2020
4ZL4
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BU of 4zl4 by Molmil
Plasmepsin V from Plasmodium vivax bound to a transition state mimetic (WEHI-842)
Descriptor: (2R)-1-[(2R)-2-(2-methoxyethoxy)propoxy]propan-2-amine, 1,2-ETHANEDIOL, Aspartic protease PM5, ...
Authors:Czabotar, P.E, Hodder, A.N, Smith, B.J, Sleebs, B.E, Gazdic, M, Boddey, J.A, Cowman, A.F.
Deposit date:2015-05-01
Release date:2015-07-15
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.37 Å)
Cite:Structural basis for plasmepsin V inhibition that blocks export of malaria proteins to human erythrocytes.
Nat.Struct.Mol.Biol., 22, 2015
7RGA
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BU of 7rga by Molmil
Crystal structure of nanoCLAMP3:VHH in complex with MTX
Descriptor: METHOTREXATE, SODIUM ION, nano CLostridial Antibody Mimetic Protein 3 VHH
Authors:Guo, Z, Alexandrov, K.
Deposit date:2021-07-14
Release date:2022-05-25
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Design of a methotrexate-controlled chemical dimerization system and its use in bio-electronic devices.
Nat Commun, 12, 2021
7M26
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BU of 7m26 by Molmil
Human carbonic anhydrase II in complex with pioglitazone
Descriptor: (5R)-5-{4-[2-(5-ethylpyridin-2-yl)ethoxy]benzyl}-1,3-thiazolidine-2,4-dione, Carbonic anhydrase 2, ZINC ION
Authors:Mueller, S.L, Peat, T.S.
Deposit date:2021-03-16
Release date:2022-02-02
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:The Glitazone Class of Drugs as Carbonic Anhydrase Inhibitors-A Spin-Off Discovery from Fragment Screening.
Molecules, 26, 2021
7M23
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BU of 7m23 by Molmil
Human carbonic anhydrase II in complex with troglitazone
Descriptor: (5R)-5-(4-{[(2R)-6-HYDROXY-2,5,7,8-TETRAMETHYL-3,4-DIHYDRO-2H-CHROMEN-2-YL]METHOXY}BENZYL)-1,3-THIAZOLIDINE-2,4-DIONE, Carbonic anhydrase 2, ZINC ION
Authors:Mueller, S.L, Peat, T.S.
Deposit date:2021-03-16
Release date:2022-02-02
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:The Glitazone Class of Drugs as Carbonic Anhydrase Inhibitors-A Spin-Off Discovery from Fragment Screening.
Molecules, 26, 2021
7M24
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BU of 7m24 by Molmil
Human carbonic anhydrase II in complex with (R)-rosiglitazone
Descriptor: (R)-ROSIGLITAZONE, Carbonic anhydrase 2, ZINC ION
Authors:Mueller, S.L, Peat, T.S.
Deposit date:2021-03-16
Release date:2022-02-02
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:The Glitazone Class of Drugs as Carbonic Anhydrase Inhibitors-A Spin-Off Discovery from Fragment Screening.
Molecules, 26, 2021
6WEU
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BU of 6weu by Molmil
Crystal structures of human E-NPP 1: bound to adenosine-5'-thio-monophosphate
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Peat, T.S, Dennis, M, Newman, J.
Deposit date:2020-04-03
Release date:2020-09-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Crystal structures of human ENPP1 in apo and bound forms.
Acta Crystallogr D Struct Biol, 76, 2020
6WFJ
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BU of 6wfj by Molmil
Crystal structures of human E-NPP 1: apo
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Peat, T.S, Dennis, M, Newman, J.
Deposit date:2020-04-03
Release date:2020-09-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystal structures of human ENPP1 in apo and bound forms.
Acta Crystallogr D Struct Biol, 76, 2020
6WEV
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BU of 6wev by Molmil
Crystal structures of human E-NPP 1: bound to N-{[1-(6,7-dimethoxy-5,8-dihydroquinazolin-4-yl)piperidin-4-yl]methyl}sulfuric diamide
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:Peat, T.S, Dennis, M, Newman, J.
Deposit date:2020-04-03
Release date:2020-09-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Crystal structures of human ENPP1 in apo and bound forms.
Acta Crystallogr D Struct Biol, 76, 2020
6WET
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BU of 6wet by Molmil
Crystal structures of human E-NPP 1: apo
Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Peat, T.S, Dennis, M, Newman, J.
Deposit date:2020-04-02
Release date:2020-09-09
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal structures of human ENPP1 in apo and bound forms.
Acta Crystallogr D Struct Biol, 76, 2020
6C62
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BU of 6c62 by Molmil
An unexpected vestigial protein complex reveals the evolutionary origins of an s-triazine catabolic enzyme.
Descriptor: AtzG, Biuret hydrolase, MAGNESIUM ION
Authors:Peat, T.S, Esquirol, L, Wilding, M, Liu, J.W, French, N.G, Hartley, C.J, Hideki, O, Easton, C.J, Newman, J, Scott, C.
Deposit date:2018-01-17
Release date:2018-03-21
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:An unexpected vestigial protein complex reveals the evolutionary origins of ans-triazine catabolic enzyme.
J. Biol. Chem., 293, 2018
6C6G
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BU of 6c6g by Molmil
An unexpected vestigial protein complex reveals the evolutionary origins of an s-triazine catabolic enzyme. Inhibitor bound complex.
Descriptor: AtzG, Biuret hydrolase, CALCIUM ION
Authors:Peat, T.S, Esquirol, L, Wilding, M, Liu, J.W, French, N.G, Hartley, C.J, Hideki, O, Easton, C.J, Newman, J, Scott, C.
Deposit date:2018-01-18
Release date:2018-03-21
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:An unexpected vestigial protein complex reveals the evolutionary origins of ans-triazine catabolic enzyme.
J. Biol. Chem., 293, 2018
7K82
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BU of 7k82 by Molmil
The X-ray crystal structure of SSR4, an S. pombe chromatin remodelling protein: sulfur SAD
Descriptor: CHLORIDE ION, GLYCEROL, SWI/SNF and RSC complexes subunit ssr4
Authors:Peat, T.S, Newman, J.
Deposit date:2020-09-24
Release date:2020-12-16
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The X-ray crystal structure of the N-terminal domain of Ssr4, a Schizosaccharomyces pombe chromatin-remodelling protein.
Acta Crystallogr.,Sect.F, 76, 2020
7K7V
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BU of 7k7v by Molmil
The X-ray crystal structure of SSR4, an S. pombe chromatin remodelling protein: iodide derivative
Descriptor: CHLORIDE ION, GLYCEROL, IODIDE ION, ...
Authors:Peat, T.S, Newman, J.
Deposit date:2020-09-24
Release date:2020-12-16
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.882 Å)
Cite:The X-ray crystal structure of the N-terminal domain of Ssr4, a Schizosaccharomyces pombe chromatin-remodelling protein.
Acta Crystallogr.,Sect.F, 76, 2020
7K7W
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BU of 7k7w by Molmil
The X-ray crystal structure of SSR4, an S. pombe chromatin remodelling protein: native
Descriptor: CHLORIDE ION, GLYCEROL, SWI/SNF and RSC complexes subunit ssr4
Authors:Peat, T.S, Newman, J.
Deposit date:2020-09-24
Release date:2020-12-16
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:The X-ray crystal structure of the N-terminal domain of Ssr4, a Schizosaccharomyces pombe chromatin-remodelling protein.
Acta Crystallogr.,Sect.F, 76, 2020
6NWM
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BU of 6nwm by Molmil
Structures of the transcriptional regulator BgaR, a lactose sensor.
Descriptor: Transcriptional regulator BgaR, beta-D-galactopyranose-(1-4)-beta-D-fructofuranose
Authors:Peat, T.S, Newman, J.
Deposit date:2019-02-06
Release date:2019-07-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Structures of the transcriptional regulator BgaR, a lactose sensor.
Acta Crystallogr D Struct Biol, 75, 2019
6NWO
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BU of 6nwo by Molmil
Structures of the transcriptional regulator BgaR, a lactose sensor.
Descriptor: CHLORIDE ION, GLYCEROL, Transcriptional regulator BgaR, ...
Authors:Peat, T.S, Newman, J.
Deposit date:2019-02-06
Release date:2019-07-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Structures of the transcriptional regulator BgaR, a lactose sensor.
Acta Crystallogr D Struct Biol, 75, 2019
6NX3
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BU of 6nx3 by Molmil
Structures of the transcriptional regulator BgaR, a lactose sensor.
Descriptor: Transcriptional regulator BgaR, beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
Authors:Peat, T.S, Newman, J.
Deposit date:2019-02-07
Release date:2019-07-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.87 Å)
Cite:Structures of the transcriptional regulator BgaR, a lactose sensor.
Acta Crystallogr D Struct Biol, 75, 2019
6NWJ
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BU of 6nwj by Molmil
Structures of the transcriptional regulator BgaR, a lactose sensor.
Descriptor: Transcriptional regulator BgaR, beta-D-galactopyranose-(1-4)-beta-D-glucopyranose
Authors:Peat, T.S, Newman, J.
Deposit date:2019-02-06
Release date:2019-07-17
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:Structures of the transcriptional regulator BgaR, a lactose sensor.
Acta Crystallogr D Struct Biol, 75, 2019

 

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