7BIG
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![BU of 7big by Molmil](/molmil-images/mine/7big) | Crystal structure of v13WRAP-T, a 7-bladed designer protein | Descriptor: | CHLORIDE ION, v13WRAP-T | Authors: | Lee, X.Y, Mylemans, B, Laier, I, Voet, A.R.D. | Deposit date: | 2021-01-12 | Release date: | 2021-09-22 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structure and stability of the designer protein WRAP-T and its permutants. Sci Rep, 11, 2021
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7BIE
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![BU of 7bie by Molmil](/molmil-images/mine/7bie) | Crystal structure of nvWrap-T, a 7-bladed symmetric propeller | Descriptor: | CITRIC ACID, nvWRAP-T | Authors: | Lee, X.Y, Mylemans, B, Laier, I, Voet, A.R.D. | Deposit date: | 2021-01-12 | Release date: | 2021-09-22 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structure and stability of the designer protein WRAP-T and its permutants. Sci Rep, 11, 2021
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7BID
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![BU of 7bid by Molmil](/molmil-images/mine/7bid) | Crystal structure of v31WRAP-T, a 7-bladed designer protein | Descriptor: | v31WRAP-T | Authors: | Laier, I, Mylemans, B, Lee, X.Y, Voet, A.R.D. | Deposit date: | 2021-01-12 | Release date: | 2021-09-22 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structure and stability of the designer protein WRAP-T and its permutants. Sci Rep, 11, 2021
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7BIF
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![BU of 7bif by Molmil](/molmil-images/mine/7bif) | Crystal structure of v22WRAP-T, a 7-bladed designer protein | Descriptor: | v22WRAP-T | Authors: | Lee, X.Y, Mylemans, B, Laier, I, Voet, A.R.D. | Deposit date: | 2021-01-12 | Release date: | 2021-09-22 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.4 Å) | Cite: | Structure and stability of the designer protein WRAP-T and its permutants. Sci Rep, 11, 2021
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6PKF
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![BU of 6pkf by Molmil](/molmil-images/mine/6pkf) | Myocilin OLF mutant N428E/D478K | Descriptor: | GLYCEROL, Myocilin | Authors: | Lieberman, R.L, Hill, S.E. | Deposit date: | 2019-06-29 | Release date: | 2019-09-11 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (1.484 Å) | Cite: | Calcium-ligand variants of the myocilin olfactomedin propeller selected from invertebrate phyla reveal cross-talk with N-terminal blade and surface helices. Acta Crystallogr D Struct Biol, 75, 2019
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6PE3
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![BU of 6pe3 by Molmil](/molmil-images/mine/6pe3) | |
7A70
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![BU of 7a70 by Molmil](/molmil-images/mine/7a70) | HEW lysozyme in complex with Ti(OH)4 | Descriptor: | 1,2-ETHANEDIOL, CHLORIDE ION, Lysozyme, ... | Authors: | Calderone, V, Gigli, L, Ravera, E, Luchinat, C. | Deposit date: | 2020-08-27 | Release date: | 2021-01-13 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | On the Mechanism of Bioinspired Formation of Inorganic Oxides: Structural Evidence of the Electrostatic Nature of the Interaction between a Mononuclear Inorganic Precursor and Lysozyme. Biomolecules, 11, 2020
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6PKD
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![BU of 6pkd by Molmil](/molmil-images/mine/6pkd) | Myocilin OLF mutant N428D/D478H | Descriptor: | Myocilin, SODIUM ION | Authors: | Lieberman, R.L, Hill, S.E. | Deposit date: | 2019-06-29 | Release date: | 2019-09-11 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Calcium-ligand variants of the myocilin olfactomedin propeller selected from invertebrate phyla reveal cross-talk with N-terminal blade and surface helices. Acta Crystallogr D Struct Biol, 75, 2019
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6QA7
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![BU of 6qa7 by Molmil](/molmil-images/mine/6qa7) | Glycogen Phosphorylase b in complex with 29 | Descriptor: | (5~{S},7~{R},8~{S},9~{S},10~{R})-7-(hydroxymethyl)-2-naphthalen-1-yl-8,9,10-tris(oxidanyl)-6-oxa-1,3-diazaspiro[4.5]dec-1-en-4-one, Glycogen phosphorylase, muscle form, ... | Authors: | Kyriakis, E, Stravodimos, G.A, Skamnaki, V.T, Leonidas, D.D. | Deposit date: | 2018-12-18 | Release date: | 2019-06-26 | Last modified: | 2019-07-24 | Method: | X-RAY DIFFRACTION (2.36 Å) | Cite: | Glucopyranosylidene-spiro-imidazolinones, a New Ring System: Synthesis and Evaluation as Glycogen Phosphorylase Inhibitors by Enzyme Kinetics and X-ray Crystallography. J.Med.Chem., 62, 2019
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8EC3
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6QA6
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![BU of 6qa6 by Molmil](/molmil-images/mine/6qa6) | Glycogen Phosphorylase b in complex with 30 | Descriptor: | (5~{S},7~{R},8~{S},9~{S},10~{R})-7-(hydroxymethyl)-2-naphthalen-2-yl-8,9,10-tris(oxidanyl)-6-oxa-1,3-diazaspiro[4.5]dec-1-en-4-one, DIMETHYL SULFOXIDE, Glycogen phosphorylase, ... | Authors: | Kyriakis, E, Stravodimos, G.A, Skamnaki, V.T, Leonidas, D.D. | Deposit date: | 2018-12-18 | Release date: | 2019-06-26 | Last modified: | 2019-07-24 | Method: | X-RAY DIFFRACTION (2.4 Å) | Cite: | Glucopyranosylidene-spiro-imidazolinones, a New Ring System: Synthesis and Evaluation as Glycogen Phosphorylase Inhibitors by Enzyme Kinetics and X-ray Crystallography. J.Med.Chem., 62, 2019
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8DND
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6QA8
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![BU of 6qa8 by Molmil](/molmil-images/mine/6qa8) | Glycogen Phosphorylase b in complex with 28 | Descriptor: | (5~{S},7~{R},8~{S},9~{S},10~{R})-7-(hydroxymethyl)-8,9,10-tris(oxidanyl)-2-phenyl-6-oxa-1,3-diazaspiro[4.5]dec-1-en-4-one, Glycogen phosphorylase, muscle form, ... | Authors: | Kyriakis, E, Stravodimos, G.A, Skamnaki, V.T, Leonidas, D.D. | Deposit date: | 2018-12-18 | Release date: | 2019-06-26 | Last modified: | 2019-07-24 | Method: | X-RAY DIFFRACTION (2.35 Å) | Cite: | Glucopyranosylidene-spiro-imidazolinones, a New Ring System: Synthesis and Evaluation as Glycogen Phosphorylase Inhibitors by Enzyme Kinetics and X-ray Crystallography. J.Med.Chem., 62, 2019
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6QE6
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![BU of 6qe6 by Molmil](/molmil-images/mine/6qe6) | Structure of M. capricolum TrmK in complex with the natural cofactor product S-adenosyl-homocysteine (SAH) | Descriptor: | S-ADENOSYL-L-HOMOCYSTEINE, tRNA (Adenine(22)-N(1))-methyltransferase | Authors: | Oerum, S, Catala, M, Atdjian, C, Brachet, F, Ponchon, L, Barraud, P, Iannazzo, L, Droogmans, L, Braud, E, Etheve-Quelquejeu, M, Tisne, C. | Deposit date: | 2019-01-04 | Release date: | 2019-03-27 | Last modified: | 2024-01-24 | Method: | X-RAY DIFFRACTION (2.36 Å) | Cite: | Bisubstrate analogues as structural tools to investigate m6A methyltransferase active sites. Rna Biol., 16, 2019
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6QE5
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![BU of 6qe5 by Molmil](/molmil-images/mine/6qe5) | Structure of E.coli RlmJ in complex with the natural cofactor product S-adenosyl-homocysteine (SAH) | Descriptor: | Ribosomal RNA large subunit methyltransferase J, S-ADENOSYL-L-HOMOCYSTEINE | Authors: | Oerum, S, Catala, M, Atdjian, C, Brachet, F, Ponchon, L, Barraud, P, Iannazzo, L, Droogmans, L, Braud, E, Etheve-Quelquejeu, M, Tisne, C. | Deposit date: | 2019-01-04 | Release date: | 2019-03-27 | Last modified: | 2024-01-24 | Method: | X-RAY DIFFRACTION (1.61 Å) | Cite: | Bisubstrate analogues as structural tools to investigate m6A methyltransferase active sites. Rna Biol., 16, 2019
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7B2B
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![BU of 7b2b by Molmil](/molmil-images/mine/7b2b) | Solution structure of a non-covalent extended docking domain complex of the Pax NRPS: PaxA T1-CDD/PaxB NDD | Descriptor: | Amino acid adenylation domain-containing protein, Peptide synthetase PaxA | Authors: | Watzel, J, Sarawi, S, Duchardt-Ferner, E, Bode, H.B, Woehnert, J. | Deposit date: | 2020-11-26 | Release date: | 2021-06-16 | Last modified: | 2024-07-03 | Method: | SOLUTION NMR | Cite: | Cooperation between a T Domain and a Minimal C-Terminal Docking Domain to Enable Specific Assembly in a Multiprotein NRPS. Angew.Chem.Int.Ed.Engl., 60, 2021
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7B2F
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![BU of 7b2f by Molmil](/molmil-images/mine/7b2f) | Solution structure of the Pax NRPS docking domain PaxB NDD | Descriptor: | Peptide synthetase XpsB (Modular protein) | Authors: | Watzel, J, Sarawi, S, Duchardt-Ferner, E, Bode, H.B, Woehnert, J. | Deposit date: | 2020-11-26 | Release date: | 2021-06-09 | Last modified: | 2024-06-19 | Method: | SOLUTION NMR | Cite: | Cooperation between a T Domain and a Minimal C-Terminal Docking Domain to Enable Specific Assembly in a Multiprotein NRPS. Angew.Chem.Int.Ed.Engl., 60, 2021
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6QE0
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![BU of 6qe0 by Molmil](/molmil-images/mine/6qe0) | Structure of E.coli RlmJ in complex with a bisubstrate analogue (BA2) | Descriptor: | (2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[2-[[9-[(2~{R},3~{R},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]ethyl]amino]-2-azanyl-butanoic acid, Ribosomal RNA large subunit methyltransferase J | Authors: | Oerum, S, Catala, M, Atdjian, C, Brachet, F, Ponchon, L, Barraud, P, Iannazzo, L, Droogmans, L, Braud, E, Etheve-Quelquejeu, M, Tisne, C. | Deposit date: | 2019-01-03 | Release date: | 2019-03-27 | Last modified: | 2024-01-24 | Method: | X-RAY DIFFRACTION (1.394 Å) | Cite: | Bisubstrate analogues as structural tools to investigate m6A methyltransferase active sites. Rna Biol., 16, 2019
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7CGC
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![BU of 7cgc by Molmil](/molmil-images/mine/7cgc) | |
8F3A
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![BU of 8f3a by Molmil](/molmil-images/mine/8f3a) | HIV-1 gp41 coiled-coil pocket IQN17 | Descriptor: | ACETIC ACID, CHLORIDE ION, IQN17 | Authors: | Bruun, T.U.J, Tang, S, Fernandez, D, Kim, P.S. | Deposit date: | 2022-11-09 | Release date: | 2023-03-08 | Last modified: | 2023-10-25 | Method: | X-RAY DIFFRACTION (1.2 Å) | Cite: | Structure-guided stabilization improves the ability of the HIV-1 gp41 hydrophobic pocket to elicit neutralizing antibodies. J.Biol.Chem., 299, 2023
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8F3B
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6QDX
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![BU of 6qdx by Molmil](/molmil-images/mine/6qdx) | Structure of E.coli RlmJ in complex with a bisubstrate analogue (BA4) | Descriptor: | (2~{S})-4-[[(2~{S},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[[9-[(2~{S},3~{R},4~{S},5~{S})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]propyl]amino]-2-azanyl-butanoic acid, Ribosomal RNA large subunit methyltransferase J | Authors: | Oerum, S, Catala, M, Atdjian, C, Brachet, F, Ponchon, L, Barraud, P, Iannazzo, L, Droogmans, L, Braud, E, Etheve-Quelquejeu, M, Tisne, C. | Deposit date: | 2019-01-03 | Release date: | 2019-03-27 | Last modified: | 2024-01-24 | Method: | X-RAY DIFFRACTION (2.1 Å) | Cite: | Bisubstrate analogues as structural tools to investigate m6A methyltransferase active sites. Rna Biol., 16, 2019
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7CGD
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![BU of 7cgd by Molmil](/molmil-images/mine/7cgd) | Silver-bound E.coli malate dehydrogenase | Descriptor: | Malate dehydrogenase, SILVER ION | Authors: | Wang, H, Wang, M, Sun, H. | Deposit date: | 2020-07-01 | Release date: | 2020-09-23 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.06 Å) | Cite: | Atomic differentiation of silver binding preference in protein targets: Escherichia coli malate dehydrogenase as a paradigm. Chem Sci, 11, 2020
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7CGV
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![BU of 7cgv by Molmil](/molmil-images/mine/7cgv) | Full consensus L-threonine 3-dehydrogenase, FcTDH-IIYM (NAD+ bound form) | Descriptor: | Artificial L-threonine 3-dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE | Authors: | Motoyama, T, Hiramatsu, N, Asano, Y, Nakano, S, Ito, S. | Deposit date: | 2020-07-02 | Release date: | 2020-10-28 | Last modified: | 2023-11-29 | Method: | X-RAY DIFFRACTION (2.38 Å) | Cite: | Protein Sequence Selection Method That Enables Full Consensus Design of Artificial l-Threonine 3-Dehydrogenases with Unique Enzymatic Properties. Biochemistry, 59, 2020
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6QUR
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