3CR0
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![BU of 3cr0 by Molmil](/molmil-images/mine/3cr0) | Wee1 kinase complex with inhibitor PD259_809 | Descriptor: | 4-(2-chlorophenyl)-8-(2-hydroxyethyl)-6-methylpyrrolo[3,4-e]indole-1,3(2H,6H)-dione, CHLORIDE ION, GLYCEROL, ... | Authors: | Squire, C.J, Baker, E.N. | Deposit date: | 2008-04-03 | Release date: | 2009-02-24 | Last modified: | 2023-11-01 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Structural determinants of Wee1 inhibitor selectivity To be Published
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3FIG
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![BU of 3fig by Molmil](/molmil-images/mine/3fig) | Crystal Structure of Leucine-bound LeuA from Mycobacterium tuberculosis | Descriptor: | 2-isopropylmalate synthase, GLYCEROL, LEUCINE, ... | Authors: | Koon, N, Squire, C.J, Baker, E.N. | Deposit date: | 2008-12-11 | Release date: | 2008-12-23 | Last modified: | 2023-11-01 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Crystal structure of LeuA from Mycobacterium tuberculosis, a key enzyme in leucine biosynthesis. Proc.Natl.Acad.Sci.USA, 101, 2004
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8G8P
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![BU of 8g8p by Molmil](/molmil-images/mine/8g8p) | |
4NI6
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![BU of 4ni6 by Molmil](/molmil-images/mine/4ni6) | |
7KB1
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![BU of 7kb1 by Molmil](/molmil-images/mine/7kb1) | Complex of O-acety-L-homoserine aminocarboxypropyltransferase (MetY) from Thermotoga maritima and a key reaction intermediate | Descriptor: | (2E)-2-[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)imino]but-3-enoic acid, MAGNESIUM ION, O-acetyl-L-homoserine sulfhydrylase, ... | Authors: | Brewster, J.L, Pachl, P, Squire, C, Selmer, M, Patrick, W.M. | Deposit date: | 2020-10-01 | Release date: | 2021-06-23 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (1.85 Å) | Cite: | Structures and kinetics of Thermotoga maritima MetY reveal new insights into the predominant sulfurylation enzyme of bacterial methionine biosynthesis. J.Biol.Chem., 296, 2021
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8DJ2
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![BU of 8dj2 by Molmil](/molmil-images/mine/8dj2) | |
5E5T
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![BU of 5e5t by Molmil](/molmil-images/mine/5e5t) | Quasi-racemic snakin-1 in P1 after radiation damage | Descriptor: | 1,2-ETHANEDIOL, D- snakin-1, FORMIC ACID, ... | Authors: | Yeung, H, Squire, C.J, Yosaatmadja, Y, Panjikar, S, Baker, E.N, Harris, P.W.R, Brimble, M.A. | Deposit date: | 2015-10-09 | Release date: | 2016-05-18 | Last modified: | 2016-07-20 | Method: | X-RAY DIFFRACTION (1.572 Å) | Cite: | Radiation Damage and Racemic Protein Crystallography Reveal the Unique Structure of the GASA/Snakin Protein Superfamily. Angew.Chem.Int.Ed.Engl., 55, 2016
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1O0K
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![BU of 1o0k by Molmil](/molmil-images/mine/1o0k) | Structure of the First Parallel DNA Quadruplex-drug Complex | Descriptor: | 5'-D(*TP*GP*GP*GP*GP*T)-3', DAUNOMYCIN, SODIUM ION | Authors: | Clark, G.R, Pytel, P.D, Squire, C.J, Neidle, S. | Deposit date: | 2003-02-22 | Release date: | 2003-04-15 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (1.17 Å) | Cite: | Structure of the First Parallel DNA Quadruplex-drug Complex J.Am.Chem.Soc., 125, 2003
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7KB0
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![BU of 7kb0 by Molmil](/molmil-images/mine/7kb0) | O-acety-L-homoserine aminocarboxypropyltransferase (MetY) from Thermotoga maritima with pyridoxal-5-phosphate (PLP) bound in the internal aldimine state | Descriptor: | O-acetyl-L-homoserine sulfhydrylase | Authors: | Brewster, J.L, Pachl, P, Squire, C, Selmer, M, Patrick, W.M. | Deposit date: | 2020-10-01 | Release date: | 2021-06-23 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (1.85 Å) | Cite: | Structures and kinetics of Thermotoga maritima MetY reveal new insights into the predominant sulfurylation enzyme of bacterial methionine biosynthesis. J.Biol.Chem., 296, 2021
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5E5Q
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![BU of 5e5q by Molmil](/molmil-images/mine/5e5q) | Racemic snakin-1 in P21/c | Descriptor: | Snakin-1 | Authors: | Yeung, H, Squire, C.J, Yosaatmadja, Y, Panjikar, S, Baker, E.N, Harris, P.W.R, Brimble, M.A. | Deposit date: | 2015-10-09 | Release date: | 2016-05-18 | Last modified: | 2016-07-20 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Radiation Damage and Racemic Protein Crystallography Reveal the Unique Structure of the GASA/Snakin Protein Superfamily. Angew.Chem.Int.Ed.Engl., 55, 2016
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7ULD
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![BU of 7uld by Molmil](/molmil-images/mine/7uld) | |
5E5Y
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![BU of 5e5y by Molmil](/molmil-images/mine/5e5y) | Quasi-racemic snakin-1 in P1 before radiation damage | Descriptor: | 1,2-ETHANEDIOL, D- snakin-1, FORMIC ACID, ... | Authors: | Yeung, H, Squire, C.J, Yosaatmadja, Y, Panjikar, S, Baker, E.N, Harris, P.W.R, Brimble, M.A. | Deposit date: | 2015-10-09 | Release date: | 2016-05-18 | Last modified: | 2016-07-20 | Method: | X-RAY DIFFRACTION (1.506 Å) | Cite: | Radiation Damage and Racemic Protein Crystallography Reveal the Unique Structure of the GASA/Snakin Protein Superfamily. Angew.Chem.Int.Ed.Engl., 55, 2016
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7ULE
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![BU of 7ule by Molmil](/molmil-images/mine/7ule) | F420-1/GDP complex of F420-gamma glutamyl ligase (CofE) from Archaeoglobus fulgidus | Descriptor: | (2~{S})-2-[[(2~{S})-2-[oxidanyl-[(2~{R},3~{S},4~{S})-2,3,4-tris(oxidanyl)-5-[2,4,8-tris(oxidanylidene)-1,9-dihydropyrimido[4,5-b]quinolin-10-yl]pentoxy]phosphoryl]oxypropanoyl]amino]pentanedioic acid, Coenzyme F420:L-glutamate ligase, GUANOSINE-5'-DIPHOSPHATE, ... | Authors: | Bashiri, G, Squire, C.J. | Deposit date: | 2022-04-04 | Release date: | 2023-04-12 | Last modified: | 2023-10-25 | Method: | X-RAY DIFFRACTION (1.7 Å) | Cite: | A Universal Mechanism for Poly-glutamylation To Be Published
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7ULF
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![BU of 7ulf by Molmil](/molmil-images/mine/7ulf) | |
2O7V
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![BU of 2o7v by Molmil](/molmil-images/mine/2o7v) | Carboxylesterase AeCXE1 from Actinidia eriantha covalently inhibited by paraoxon | Descriptor: | CXE carboxylesterase, DIETHYL PHOSPHONATE | Authors: | Ileperuma, N.R, Marshall, S.D, Squire, C.J, Baker, H.M, Oakeshott, J.G, Russell, R.J, Plummer, K.M, Newcomb, R.D, Baker, E.N. | Deposit date: | 2006-12-11 | Release date: | 2007-02-27 | Last modified: | 2024-04-03 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | High-Resolution Crystal Structure of Plant Carboxylesterase AeCXE1, from Actinidia eriantha, and Its Complex with a High-Affinity Inhibitor Paraoxon. Biochemistry, 46, 2007
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2O7R
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![BU of 2o7r by Molmil](/molmil-images/mine/2o7r) | Plant carboxylesterase AeCXE1 from Actinidia eriantha with acyl adduct | Descriptor: | CXE carboxylesterase, PROPYL ACETATE | Authors: | Ileperuma, N.R, Marshall, S.D, Squire, C.J, Baker, H.M, Oakeshott, J.G, Russell, R.J, Plummer, K.M, Newcomb, R.D, Baker, E.N. | Deposit date: | 2006-12-11 | Release date: | 2007-02-27 | Last modified: | 2023-12-27 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | High-Resolution Crystal Structure of Plant Carboxylesterase AeCXE1, from Actinidia eriantha, and Its Complex with a High-Affinity Inhibitor Paraoxon. Biochemistry, 46, 2007
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3HPX
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![BU of 3hpx by Molmil](/molmil-images/mine/3hpx) | |
8EVO
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![BU of 8evo by Molmil](/molmil-images/mine/8evo) | |
8EVN
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![BU of 8evn by Molmil](/molmil-images/mine/8evn) | |
8F90
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![BU of 8f90 by Molmil](/molmil-images/mine/8f90) | |
1SR9
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![BU of 1sr9 by Molmil](/molmil-images/mine/1sr9) | Crystal Structure of LeuA from Mycobacterium tuberculosis | Descriptor: | 2-isopropylmalate synthase, 3-METHYL-2-OXOBUTANOIC ACID, CHLORIDE ION, ... | Authors: | Koon, N, Squire, C.J, Baker, E.N. | Deposit date: | 2004-03-22 | Release date: | 2004-05-18 | Last modified: | 2017-10-11 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Crystal structure of LeuA from Mycobacterium tuberculosis, a key enzyme in leucine biosynthesis Proc.Natl.Acad.Sci.USA, 101, 2004
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8FHA
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448D
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![BU of 448d by Molmil](/molmil-images/mine/448d) | 5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3', BENZIMIDAZOLE DERIVATIVE COMPLEX | Descriptor: | 2'-(3-IODO-4-METHOXYPHENYL)-5-(4-METHYL-1-PIPERAZINYL)-2,5'-BI-BENZIMIDAZOLE, DNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*CP*GP*CP*G)-3') | Authors: | Clark, G.R, Squire, C.J, Martin, R.F, White, J. | Deposit date: | 1999-01-20 | Release date: | 2000-02-02 | Last modified: | 2023-12-27 | Method: | X-RAY DIFFRACTION (2.2 Å) | Cite: | Structures of m-iodo Hoechst-DNA complexes in crystals with reduced solvent content: implications for minor groove binder drug design. Nucleic Acids Res., 28, 2000
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8F9L
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![BU of 8f9l by Molmil](/molmil-images/mine/8f9l) | |
3HQ1
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![BU of 3hq1 by Molmil](/molmil-images/mine/3hq1) | |