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2IXJ
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BU of 2ixj by Molmil
RmlC P aeruginosa native
Descriptor: DTDP-4-DEHYDRORHAMNOSE 3,5-EPIMERASE, S,R MESO-TARTARIC ACID
Authors:Dong, C, Naismith, J.H.
Deposit date:2006-07-08
Release date:2006-07-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.54 Å)
Cite:Rmlc, a C3' and C5' Carbohydrate Epimerase, Appears to Operate Via an Intermediate with an Unusual Twist Boat Conformation.
J.Mol.Biol., 365, 2007
2IXI
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BU of 2ixi by Molmil
RmlC P aeruginosa with dTDP-xylose
Descriptor: DTDP-4-DEHYDRORHAMNOSE 3,5-EPIMERASE, S,R MESO-TARTARIC ACID, THYMIDINE-5'-DIPHOSPHATE
Authors:Dong, C, Naismith, J.H.
Deposit date:2006-07-08
Release date:2006-07-11
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Rmlc, a C3' and C5' Carbohydrate Epimerase, Appears to Operate Via an Intermediate with an Unusual Twist Boat Conformation.
J.Mol.Biol., 365, 2007
2IXK
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BU of 2ixk by Molmil
RmlC P aeruginosa with dTDP-4-keto rhamnnose (the product of the reaction)
Descriptor: DTDP-4-DEHYDRORHAMNOSE 3,5-EPIMERASE, DTDP-4-KETO-L-RHAMNOSE
Authors:Dong, C, Naismith, J.H.
Deposit date:2006-07-08
Release date:2006-08-14
Last modified:2025-04-09
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Rmlc, a C3' and C5' Carbohydrate Epimerase, Appears to Operate Via an Intermediate with an Unusual Twist Boat Conformation.
J.Mol.Biol., 365, 2007
3OHL
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BU of 3ohl by Molmil
catalytic domain of stromelysin-1 in complex with N-Hydroxy-2-(4-methoxy-N-(pyridine-3-ylmethyl)phenylsulfonamido)acetamide
Descriptor: CALCIUM ION, N-hydroxy-N~2~-[(4-methoxyphenyl)sulfonyl]-N~2~-(pyridin-4-ylmethyl)glycinamide, SULFATE ION, ...
Authors:Kowatz, T, Naismith, J.H.
Deposit date:2010-08-17
Release date:2011-06-29
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.36 Å)
Cite:Non-Resonance Raman Difference Spectroscopy as a Tool to Probe Enthalpy-Entropy Compensation and the Interfacial Mobility Model
To be Published
3OHO
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BU of 3oho by Molmil
catalytic domain of stromelysin-1 in complex with N-Hydroxy-2-(4-methylphenylsulfonamido)acetamide
Descriptor: CALCIUM ION, N-hydroxy-N~2~-[(4-methoxyphenyl)sulfonyl]glycinamide, SULFATE ION, ...
Authors:Kowatz, T, Naismith, J.H.
Deposit date:2010-08-17
Release date:2011-06-29
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Non-Resonance Raman Difference Spectroscopy as a Tool to Probe Enthalpy-Entropy Compensation and the Interfacial Mobility Model
To be Published
1KD0
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BU of 1kd0 by Molmil
Crystal Structure of beta-methylaspartase from Clostridium tetanomorphum. Apo-structure.
Descriptor: 1,2-ETHANEDIOL, beta-methylaspartase
Authors:Asuncion, M, Blankenfeldt, W, Barlow, J.N, Gani, D, Naismith, J.H.
Deposit date:2001-11-12
Release date:2001-12-19
Last modified:2024-10-16
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The structure of 3-methylaspartase from Clostridium tetanomorphum functions via the common enolase chemical step.
J.Biol.Chem., 277, 2002
1KCZ
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BU of 1kcz by Molmil
Crystal Structure of beta-methylaspartase from Clostridium tetanomorphum. Mg-complex.
Descriptor: 1,2-ETHANEDIOL, MAGNESIUM ION, beta-methylaspartase
Authors:Asuncion, M, Blankenfeldt, W, Barlow, J.N, Gani, D, Naismith, J.H.
Deposit date:2001-11-12
Release date:2001-12-19
Last modified:2025-03-26
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The structure of 3-methylaspartase from Clostridium tetanomorphum functions via the common enolase chemical step.
J.Biol.Chem., 277, 2002
5FIU
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BU of 5fiu by Molmil
Binding and structural studies of a 5,5-difluoromethyl adenosine nucleoside with the fluorinase enzyme
Descriptor: 5'-FLUORO-5'-DEOXY-ADENOSINE SYNTHASE, 5,5-DIFLUOROMETHYL ADENOSINE, L(+)-TARTARIC ACID
Authors:Thompson, S, McMahon, S.A, Naismith, J.H, O'Hagan, D.
Deposit date:2015-10-02
Release date:2015-12-23
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Exploration of a Potential Difluoromethyl-Nucleoside Substrate with the Fluorinase Enzyme.
Bioorg.Chem., 64, 2015
1WA3
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BU of 1wa3 by Molmil
Mechanism of the Class I KDPG aldolase
Descriptor: 2-KETO-3-DEOXY-6-PHOSPHOGLUCONATE ALDOLASE, PYRUVIC ACID, SULFATE ION
Authors:Fullerton, S.W.B, Griffiths, J.S, Merkel, A.B, Wymer, N.J, Hutchins, M.J, Fierke, C.A, Toone, E.J, Naismith, J.H.
Deposit date:2004-10-22
Release date:2005-01-26
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Mechanism of the Class I Kdpg Aldolase.
Bioorg.Med.Chem., 14, 2006
1WAU
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BU of 1wau by Molmil
Structure of KDPG Aldolase E45N mutant
Descriptor: KHG/KDPG ALDOLASE, SULFATE ION
Authors:Merkel, A.B, Naismith, J.H.
Deposit date:2004-10-28
Release date:2006-01-18
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Mechanism of the Class I Kdpg Aldolase.
Bioorg.Med.Chem., 14, 2006
1WAM
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BU of 1wam by Molmil
Structure of UDP-galactopyranose mutase from Klebsiella Pneumoniae with FADH-
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, UDP-GALACTOPYRANOSE MUTASE
Authors:Beis, K, Srikannathasan, V, Naismith, J.H.
Deposit date:2004-10-27
Release date:2006-05-24
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Crystal Structures of Mycobacteria Tuberculosis and Klebsiella Pneumoniae Udp-Galactopyranose Mutase in the Oxidised State and Klebsiella Pneumoniae Udp-Galactopyranose Mutase in the (Active) Reduced State.
J.Mol.Biol., 348, 2005
1WBH
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BU of 1wbh by Molmil
Crystal structure of the E45N mutant from KDPG aldolase from Escherichia coli
Descriptor: KHG/KDPG ALDOLASE, PHOSPHATE ION
Authors:Fullerton, S.W.B, Merkel, A.B, Naismith, J.H.
Deposit date:2004-11-01
Release date:2006-01-18
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Mechanism of the Class I Kdpg Aldolase.
Bioorg.Med.Chem., 14, 2006
9EXO
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BU of 9exo by Molmil
Wzc-K540M-2YE MgADP C1
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Putative transmembrane protein Wzc
Authors:Liu, J.W, Yang, Y, Naismith, J.H.
Deposit date:2024-04-08
Release date:2025-04-23
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Molecular basis for the phosphorylation of bacterial tyrosine kinase Wzc.
Nat Commun, 16, 2025
9EXR
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BU of 9exr by Molmil
Wzc-K540M-3YE-N711Y MgADP C8
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Putative transmembrane protein Wzc
Authors:Liu, J.W, Yang, Y, Naismith, J.H.
Deposit date:2024-04-08
Release date:2025-04-23
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (2.49 Å)
Cite:Molecular basis for the phosphorylation of bacterial tyrosine kinase Wzc.
Nat Commun, 16, 2025
9EXP
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BU of 9exp by Molmil
Wzc-K540M-2YE MgADP C8
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Putative transmembrane protein Wzc
Authors:Liu, J.W, Yang, Y, Naismith, J.H.
Deposit date:2024-04-08
Release date:2025-04-23
Last modified:2025-07-02
Method:ELECTRON MICROSCOPY (2.85 Å)
Cite:Molecular basis for the phosphorylation of bacterial tyrosine kinase Wzc.
Nat Commun, 16, 2025
9EXQ
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BU of 9exq by Molmil
Wzc-K540M-3YE-N711Y MgADP C1
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Putative transmembrane protein Wzc
Authors:Liu, J.W, Yang, Y, Naismith, J.H.
Deposit date:2024-04-08
Release date:2025-04-23
Last modified:2025-07-09
Method:ELECTRON MICROSCOPY (2.71 Å)
Cite:Molecular basis for the phosphorylation of bacterial tyrosine kinase Wzc.
Nat Commun, 16, 2025
2APG
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BU of 2apg by Molmil
The structure of tryptophan 7-halogenase (PrnA)suggests a mechanism for regioselective chlorination
Descriptor: CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION, ...
Authors:Dong, C, Flecks, S, Unversucht, S, Haupt, C, Van Pee, K.H, Naismith, J.H, Scottish Structural Proteomics Facility (SSPF)
Deposit date:2005-08-16
Release date:2005-10-04
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Tryptophan 7-halogenase (PrnA) structure suggests a mechanism for regioselective chlorination.
Science, 309, 2005
9I2Q
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BU of 9i2q by Molmil
Wzc-K540M-3YE MgADP C1
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Putative transmembrane protein Wzc
Authors:Liu, J.W, Yang, Y, Naismith, J.H.
Deposit date:2025-01-22
Release date:2025-04-30
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Molecular basis for the phosphorylation of bacterial tyrosine kinase Wzc.
Nat Commun, 16, 2025
2IYD
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BU of 2iyd by Molmil
SENP1 covalent complex with SUMO-2
Descriptor: SENTRIN-SPECIFIC PROTEASE 1, SMALL UBIQUITIN-RELATED MODIFIER 2
Authors:Dong, C, Naismith, J.H.
Deposit date:2006-07-14
Release date:2006-08-08
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Senp1 Native Structure
To be Published
2IYC
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BU of 2iyc by Molmil
SENP1 native structure
Descriptor: SENTRIN-SPECIFIC PROTEASE 1
Authors:Dong, C, Naismith, J.H.
Deposit date:2006-07-14
Release date:2006-08-08
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Senp1 Native Structure
To be Published
2C4U
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BU of 2c4u by Molmil
Crystal structure of the apo form of the 5'-Fluoro-5'-deoxyadenosine synthase enzyme from Streptomyces cattleya
Descriptor: 5'-FLUORO-5'-DEOXYADENOSINE SYNTHASE, GLYCEROL
Authors:McEwan, A.R, Deng, H, Robinson, D.A, DeLaurentis, W, McGlinchey, R.P, O'Hagan, D, Naismith, J.H.
Deposit date:2005-10-22
Release date:2006-04-12
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Substrate specificity in enzymatic fluorination. The fluorinase from Streptomyces cattleya accepts 2'-deoxyadenosine substrates.
Org. Biomol. Chem., 4, 2006
2C5B
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BU of 2c5b by Molmil
X-ray crystal structure of 5'-fluorodeoxyadenosine synthase from Streptomyces cattleya complexed with 2'deoxy-5'deoxy-fluoroadenosine.
Descriptor: 5'-FLUORO-2',5'-DIDEOXYADENOSINE, 5'-FLUORO-5'-DEOXYADENOSINE SYNTHASE, METHIONINE
Authors:McEwan, A.R, Deng, H, McGlinchey, R.P, Robinson, D.A, O'Hagan, D, Naismith, J.H, Spencer, J.
Deposit date:2005-10-26
Release date:2007-02-20
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Substrate Specificity in Enzymatic Fluorination. The Fluorinase from Streptomyces Cattleya Accepts 2'-Deoxyadenosine Substrates.
Org.Biomol.Chem., 4, 2006
9I2R
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BU of 9i2r by Molmil
Wzc-K540M-3YE MgADP C8
Descriptor: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Putative transmembrane protein Wzc
Authors:Liu, J.W, Yang, Y, Naismith, J.H.
Deposit date:2025-01-22
Release date:2025-04-30
Method:ELECTRON MICROSCOPY (2.59 Å)
Cite:Molecular basis for the phosphorylation of bacterial tyrosine kinase Wzc.
Nat Commun, 16, 2025
2AQJ
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BU of 2aqj by Molmil
The structure of tryptophan 7-halogenase (PrnA) suggests a mechanism for regioselective chlorination
Descriptor: CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, TRYPTOPHAN, ...
Authors:Dong, C, Flecks, S, Unversucht, S, Haupt, C, Van Pee, K.-H, Naismith, J.H, Scottish Structural Proteomics Facility (SSPF)
Deposit date:2005-08-18
Release date:2005-10-04
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Tryptophan 7-halogenase (PrnA) structure suggests a mechanism for regioselective chlorination.
Science, 309, 2005
2AR8
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BU of 2ar8 by Molmil
The structure of tryptophan 7-halogenase (PrnA)suggests a mechanism for regioselective chlorination
Descriptor: 7-CHLOROTRYPTOPHAN, CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, ...
Authors:Dong, C, Flecks, S, Unversucht, S, Haupt, C, Van Pee, K.H, Naismith, J.H, Scottish Structural Proteomics Facility (SSPF)
Deposit date:2005-08-19
Release date:2005-10-04
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Tryptophan 7-halogenase (PrnA) structure suggests a mechanism for regioselective chlorination.
Science, 309, 2005

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