5XZI
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5XZJ
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7PUO
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![BU of 7puo by Molmil](/molmil-images/mine/7puo) | Structure of a fused 4-OT variant engineered for asymmetric Michael addition reactions | 分子名称: | 2-hydroxymuconate tautomerase,Chains: A,B,C,D,E,F,2-hydroxymuconate tautomerase, CHLORIDE ION, GLYCEROL | 著者 | Rozeboom, H.J, Thunnissen, A.M.W.H, Poelarends, G.J. | 登録日 | 2021-09-30 | 公開日 | 2022-01-26 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (2.35 Å) | 主引用文献 | Gene Fusion and Directed Evolution to Break Structural Symmetry and Boost Catalysis by an Oligomeric C-C Bond-Forming Enzyme. Angew.Chem.Int.Ed.Engl., 61, 2022
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4TQD
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![BU of 4tqd by Molmil](/molmil-images/mine/4tqd) | Crystal Structure of the C-terminal domain of IFRS bound with 3-iodo-L-Phe and ATP | 分子名称: | 1,2-ETHANEDIOL, 3-iodo-L-phenylalanine, ADENOSINE-5'-TRIPHOSPHATE, ... | 著者 | Nakamura, A, O'Donoghue, P, Soll, D. | 登録日 | 2014-06-11 | 公開日 | 2014-11-12 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2.1429 Å) | 主引用文献 | Polyspecific pyrrolysyl-tRNA synthetases from directed evolution. Proc.Natl.Acad.Sci.USA, 111, 2014
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4TQF
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![BU of 4tqf by Molmil](/molmil-images/mine/4tqf) | Crystal Structure of the C-terminal domain of IFRS bound with 2-(5-bromothienyl)-L-Ala and ATP | 分子名称: | 1,2-ETHANEDIOL, 3-(5-bromothiophen-2-yl)-L-alanine, ADENOSINE-5'-TRIPHOSPHATE, ... | 著者 | Nakamura, A, O'Donoghue, P, Soll, D. | 登録日 | 2014-06-11 | 公開日 | 2014-11-12 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (2.7143 Å) | 主引用文献 | Polyspecific pyrrolysyl-tRNA synthetases from directed evolution. Proc.Natl.Acad.Sci.USA, 111, 2014
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6QM2
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![BU of 6qm2 by Molmil](/molmil-images/mine/6qm2) | NlaIV restriction endonuclease | 分子名称: | POTASSIUM ION, SODIUM ION, Type-2 restriction enzyme NlaIV | 著者 | Czapinska, H, Siwek, W, Szczepanowski, R.H, Bujnicki, J.M, Bochtler, M, Skowronek, K. | 登録日 | 2019-02-01 | 公開日 | 2019-05-01 | 最終更新日 | 2024-05-15 | 実験手法 | X-RAY DIFFRACTION (2.8 Å) | 主引用文献 | Crystal Structure and Directed Evolution of Specificity of NlaIV Restriction Endonuclease. J.Mol.Biol., 431, 2019
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8F7Z
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![BU of 8f7z by Molmil](/molmil-images/mine/8f7z) | VRC34.01_mm28 bound to fusion peptide | 分子名称: | HIV-1 Env Fusion Peptide, VRC34_m228 Light Chain, VRC34_mm28 Heavy Chain | 著者 | Olia, A.S, Kwong, P.D. | 登録日 | 2022-11-21 | 公開日 | 2023-11-01 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (2.7 Å) | 主引用文献 | Antibody-directed evolution reveals a mechanism for enhanced neutralization at the HIV-1 fusion peptide site. Nat Commun, 14, 2023
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4FTW
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![BU of 4ftw by Molmil](/molmil-images/mine/4ftw) | Crystal structure of a carboxyl esterase N110C/L145H at 2.3 angstrom resolution | 分子名称: | 3-CYCLOHEXYLPROPYL 4-O-ALPHA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE, CHLORIDE ION, PIPERAZINE-N,N'-BIS(2-ETHANESULFONIC ACID), ... | 著者 | Wu, L, Ma, J, Zhou, J, Yu, H. | 登録日 | 2012-06-28 | 公開日 | 2012-10-03 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Enhanced enantioselectivity of a carboxyl esterase from Rhodobacter sphaeroides by directed evolution. Appl.Microbiol.Biotechnol., 97, 2013
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4FHZ
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![BU of 4fhz by Molmil](/molmil-images/mine/4fhz) | Crystal structure of a carboxyl esterase at 2.0 angstrom resolution | 分子名称: | DI(HYDROXYETHYL)ETHER, Phospholipase/Carboxylesterase, SODIUM ION | 著者 | Wu, L, Ma, J, Zhou, J, Yu, H. | 登録日 | 2012-06-07 | 公開日 | 2012-10-03 | 最終更新日 | 2024-02-28 | 実験手法 | X-RAY DIFFRACTION (2.01 Å) | 主引用文献 | Enhanced enantioselectivity of a carboxyl esterase from Rhodobacter sphaeroides by directed evolution. Appl.Microbiol.Biotechnol., 97, 2013
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3PY8
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![BU of 3py8 by Molmil](/molmil-images/mine/3py8) | Crystal structure of a mutant of the large fragment of DNA polymerase I from thermus aquaticus in a closed ternary complex with DNA and ddCTP | 分子名称: | 2',3'-DIDEOXYCYTIDINE 5'-TRIPHOSPHATE, DNA (5'-D(*AP*A*AP*GP*GP*GP*CP*GP*CP*CP*GP*TP*GP*GP*TP*C)-3'), DNA (5'-D(*GP*AP*CP*CP*AP*CP*GP*GP*CP*GP*CP*(DOC))-3'), ... | 著者 | Schnur, A, Marx, A, Welte, W, Diederichs, K. | 登録日 | 2010-12-12 | 公開日 | 2011-06-15 | 最終更新日 | 2024-02-21 | 実験手法 | X-RAY DIFFRACTION (1.74 Å) | 主引用文献 | Learning from Directed Evolution: Thermus aquaticus DNA Polymerase Mutants with Translesion Synthesis Activity. Chembiochem, 12, 2011
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5RG8
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![BU of 5rg8 by Molmil](/molmil-images/mine/5rg8) | Crystal Structure of Kemp Eliminase HG3.17 in unbound state, 277K | 分子名称: | ACETATE ION, Kemp Eliminase HG3 | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.73 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RG6
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![BU of 5rg6 by Molmil](/molmil-images/mine/5rg6) | Crystal Structure of Kemp Eliminase HG3.7 in unbound state, 277K | 分子名称: | Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.35 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RG5
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![BU of 5rg5 by Molmil](/molmil-images/mine/5rg5) | Crystal Structure of Kemp Eliminase HG3.3b in unbound state, 277K | 分子名称: | ACETATE ION, Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2021-05-12 | 実験手法 | X-RAY DIFFRACTION (1.62 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RGB
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![BU of 5rgb by Molmil](/molmil-images/mine/5rgb) | Crystal Structure of Kemp Eliminase HG3.3b with bound transition state analogue, 277K | 分子名称: | 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3.3b, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2021-05-12 | 実験手法 | X-RAY DIFFRACTION (1.42 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RG9
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![BU of 5rg9 by Molmil](/molmil-images/mine/5rg9) | Crystal Structure of Kemp Eliminase HG4 in unbound state, 277K | 分子名称: | ACETATE ION, Kemp Eliminase HG4, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2021-05-12 | 実験手法 | X-RAY DIFFRACTION (1.47 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RGF
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![BU of 5rgf by Molmil](/molmil-images/mine/5rgf) | Crystal Structure of Kemp Eliminase HG4 with bound transition state analogue, 277K | 分子名称: | 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.46 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RG4
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![BU of 5rg4 by Molmil](/molmil-images/mine/5rg4) | Crystal Structure of Kemp Eliminase HG3 in unbound state, 277K | 分子名称: | ACETATE ION, Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2021-05-12 | 実験手法 | X-RAY DIFFRACTION (1.99 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RGD
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![BU of 5rgd by Molmil](/molmil-images/mine/5rgd) | Crystal Structure of Kemp Eliminase HG3.14 with bound transition state analogue, 277K | 分子名称: | 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3.14, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.6 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RGA
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![BU of 5rga by Molmil](/molmil-images/mine/5rga) | Crystal Structure of Kemp Eliminase HG3 with bound transition state analogue, 277K | 分子名称: | 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2021-05-12 | 実験手法 | X-RAY DIFFRACTION (1.86 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RG7
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![BU of 5rg7 by Molmil](/molmil-images/mine/5rg7) | Crystal Structure of Kemp Eliminase HG3.14 in unbound state, 277K | 分子名称: | Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.47 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RGC
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![BU of 5rgc by Molmil](/molmil-images/mine/5rgc) | Crystal Structure of Kemp Eliminase HG3.7 with bound transition state analogue, 277K | 分子名称: | 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3, SULFATE ION | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2021-05-12 | 実験手法 | X-RAY DIFFRACTION (1.39 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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5RGE
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![BU of 5rge by Molmil](/molmil-images/mine/5rge) | Crystal Structure of Kemp Eliminase HG3.17 with bound transition state analog, 277K | 分子名称: | 6-NITROBENZOTRIAZOLE, Kemp Eliminase HG3 | 著者 | Broom, A, Rakotoharisoa, R.V, Thompson, M.C, Fraser, J.S, Chica, R.A. | 登録日 | 2020-03-19 | 公開日 | 2020-07-22 | 最終更新日 | 2024-03-06 | 実験手法 | X-RAY DIFFRACTION (1.77 Å) | 主引用文献 | Ensemble-based enzyme design can recapitulate the effects of laboratory directed evolution in silico. Nat Commun, 11, 2020
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7P76
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![BU of 7p76 by Molmil](/molmil-images/mine/7p76) | Re-engineered 2-deoxy-D-ribose-5-phosphate aldolase catalysing asymmetric Michael addition reactions, Schiff base complex with cinnamaldehyde | 分子名称: | (2E)-3-phenylprop-2-enal, Deoxyribose-phosphate aldolase, GLYCEROL | 著者 | Thunnissen, A.M.W.H, Rozeboom, H.J, Kunzendorf, A, Poelarends, G.J. | 登録日 | 2021-07-19 | 公開日 | 2021-10-27 | 最終更新日 | 2024-01-31 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | Unlocking Asymmetric Michael Additions in an Archetypical Class I Aldolase by Directed Evolution. Acs Catalysis, 11, 2021
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7P75
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6FKX
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![BU of 6fkx by Molmil](/molmil-images/mine/6fkx) | Crystal structure of an acetyl xylan esterase from a desert metagenome | 分子名称: | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Acetyl xylan esterase, FORMIC ACID, ... | 著者 | Adesioye, F.A, Makhalanyane, T.P, Vikram, S, Sewell, B.T, Schubert, W, Cowan, D.A. | 登録日 | 2018-01-24 | 公開日 | 2018-02-28 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (2.03 Å) | 主引用文献 | Structural Characterization and Directed Evolution of a Novel Acetyl Xylan Esterase Reveals Thermostability Determinants of the Carbohydrate Esterase 7 Family. Appl. Environ. Microbiol., 84, 2018
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