8CAR
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![BU of 8car by Molmil](/molmil-images/mine/8car) | Discovery of the lanthipeptide Curvocidin and structural insights into its trifunctional synthetase CuvL | Descriptor: | NITRATE ION, PHOSPHATE ION, Serine/threonine protein kinase | Authors: | Martins, B.M, Sigurdsson, A, Duettmann, A.A, Jasyk, M, Dimos-Roehl, B, Schoepf, F, Gemander, M, Knittel, C.H, Schegotzki, R, Schmid, B, Kosol, S, Pommerening, L, Gonzalez-Viegas, M, Seidel, M, Huegelland, M, Leimkuehler, S, Dobbek, H, Mainz, A, Suessmuth, R. | Deposit date: | 2023-01-24 | Release date: | 2023-06-14 | Last modified: | 2023-11-15 | Method: | X-RAY DIFFRACTION (2.68 Å) | Cite: | Discovery of the Lanthipeptide Curvocidin and Structural Insights into its Trifunctional Synthetase CuvL. Angew.Chem.Int.Ed.Engl., 62, 2023
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1Z02
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![BU of 1z02 by Molmil](/molmil-images/mine/1z02) | 2-Oxoquinoline 8-Monooxygenase Component: Active site Modulation by Rieske-[2fe-2S] Center Oxidation/Reduction | Descriptor: | 2-oxo-1,2-dihydroquinoline 8-monooxygenase, oxygenase component, FE (III) ION, ... | Authors: | Martins, B.M, Svetlitchnaia, T, Dobbek, H. | Deposit date: | 2005-03-01 | Release date: | 2005-05-24 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | 2-Oxoquinoline 8-Monooxygenase Oxygenase Component: Active Site Modulation by Rieske-[2Fe-2S] Center Oxidation/Reduction Structure, 13, 2005
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1Z03
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![BU of 1z03 by Molmil](/molmil-images/mine/1z03) | 2-Oxoquinoline 8-Monooxygenase Component: Active site Modulation by Rieske-[2fe-2S] Center Oxidation/Reduction | Descriptor: | 2-oxo-1,2-dihydroquinoline 8-monooxygenase, oxygenase component, FE (III) ION, ... | Authors: | Martins, B.M, Svetlitchnaia, T, Dobbek, H. | Deposit date: | 2005-03-01 | Release date: | 2005-05-24 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | 2-Oxoquinoline 8-Monooxygenase Oxygenase Component: Active Site Modulation by Rieske-[2Fe-2S] Center Oxidation/Reduction Structure, 13, 2005
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1Z01
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![BU of 1z01 by Molmil](/molmil-images/mine/1z01) | 2-Oxoquinoline 8-Monooxygenase Component: Active site Modulation by Rieske-[2fe-2S] Center Oxidation/Reduction | Descriptor: | 2-oxo-1,2-dihydroquinoline 8-monooxygenase, oxygenase component, FE (III) ION, ... | Authors: | Martins, B.M, Svetlitchnaia, T, Dobbek, H. | Deposit date: | 2005-03-01 | Release date: | 2005-05-24 | Last modified: | 2024-03-13 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | 2-Oxoquinoline 8-Monooxygenase Oxygenase Component: Active Site Modulation by Rieske-[2Fe-2S] Center Oxidation/Reduction Structure, 13, 2005
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1U8V
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![BU of 1u8v by Molmil](/molmil-images/mine/1u8v) | Crystal Structure of 4-Hydroxybutyryl-CoA Dehydratase from Clostridium aminobutyricum: Radical catalysis involving a [4Fe-4S] cluster and flavin | Descriptor: | FLAVIN-ADENINE DINUCLEOTIDE, Gamma-aminobutyrate metabolism dehydratase/isomerase, IRON/SULFUR CLUSTER | Authors: | Martins, B.M, Dobbek, H, Cinkaya, I, Buckel, W, Messerschmidt, A. | Deposit date: | 2004-08-07 | Release date: | 2004-12-21 | Last modified: | 2024-02-14 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Crystal structure of 4-hydroxybutyryl-CoA dehydratase: radical catalysis involving a [4Fe-4S] cluster and flavin. Proc.Natl.Acad.Sci.USA, 101, 2004
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1J93
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![BU of 1j93 by Molmil](/molmil-images/mine/1j93) | Crystal Structure and Substrate Binding Modeling of the Uroporphyrinogen-III Decarboxylase from Nicotiana tabacum: Implications for the Catalytic Mechanism | Descriptor: | SULFATE ION, UROPORPHYRINOGEN DECARBOXYLASE | Authors: | Martins, B.M, Grimm, B, Mock, H.-P, Huber, R, Messerschmidt, A. | Deposit date: | 2001-05-23 | Release date: | 2001-10-17 | Last modified: | 2023-08-16 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Crystal structure and substrate binding modeling of the uroporphyrinogen-III decarboxylase from Nicotiana tabacum. Implications for the catalytic mechanism J.Biol.Chem., 276, 2001
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2YAJ
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![BU of 2yaj by Molmil](/molmil-images/mine/2yaj) | CRYSTAL STRUCTURE OF GLYCYL RADICAL ENZYME with bound substrate | Descriptor: | 4-HYDROXYPHENYLACETATE, 4-HYDROXYPHENYLACETATE DECARBOXYLASE LARGE SUBUNIT, 4-HYDROXYPHENYLACETATE DECARBOXYLASE SMALL SUBUNIT, ... | Authors: | Martins, B.M, Blaser, M, Feliks, M, Ullmann, G.M, Selmer, T. | Deposit date: | 2011-02-23 | Release date: | 2011-09-21 | Last modified: | 2023-12-20 | Method: | X-RAY DIFFRACTION (1.813 Å) | Cite: | Structural Basis for a Kolbe-Type Decarboxylation Catalyzed by a Glycyl Radical Enzyme. J.Am.Chem.Soc., 133, 2011
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1XDW
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![BU of 1xdw by Molmil](/molmil-images/mine/1xdw) | NAD+-dependent (R)-2-Hydroxyglutarate Dehydrogenase from Acidaminococcus fermentans | Descriptor: | NAD+-dependent (R)-2-Hydroxyglutarate Dehydrogenase | Authors: | Martins, B.M, Macedo-Ribeiro, S, Bresser, J, Buckel, W, Messerschmidt, A. | Deposit date: | 2004-09-08 | Release date: | 2005-03-08 | Last modified: | 2024-02-14 | Method: | X-RAY DIFFRACTION (1.98 Å) | Cite: | Structural basis for stereo-specific catalysis in NAD(+)-dependent (R)-2-hydroxyglutarate dehydrogenase from Acidaminococcus fermentans. Febs J., 272, 2005
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2Y8N
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![BU of 2y8n by Molmil](/molmil-images/mine/2y8n) | Crystal structure of glycyl radical enzyme | Descriptor: | 4-HYDROXYPHENYLACETATE DECARBOXYLASE LARGE SUBUNIT, 4-HYDROXYPHENYLACETATE DECARBOXYLASE SMALL SUBUNIT, IRON/SULFUR CLUSTER | Authors: | Martins, B.M, Blaser, M, Feliks, M, Ullmann, G.M, Selmer, T. | Deposit date: | 2011-02-08 | Release date: | 2011-09-21 | Last modified: | 2023-12-20 | Method: | X-RAY DIFFRACTION (1.75 Å) | Cite: | Structural Basis for a Kolbe-Type Decarboxylation Catalyzed by a Glycyl Radical Enzyme. J.Am.Chem.Soc., 133, 2011
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5NSF
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![BU of 5nsf by Molmil](/molmil-images/mine/5nsf) | Structure of AzuAla | Descriptor: | (2~{S})-2-azanyl-3-(2,6-dihydroazulen-1-yl)propanoic acid, CALCIUM ION, GLYCEROL, ... | Authors: | Martins, B.M. | Deposit date: | 2017-04-26 | Release date: | 2019-01-16 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (2.426 Å) | Cite: | Site-Resolved Observation of Vibrational Energy Transfer Using a Genetically Encoded Ultrafast Heater. Angew. Chem. Int. Ed. Engl., 58, 2019
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2MCT
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![BU of 2mct by Molmil](/molmil-images/mine/2mct) | NMR structure of the protein ZP_02042476.1 from Ruminococcus gnavus | Descriptor: | Uncharacterized protein | Authors: | Martin, B.T, Serrano, P, Geralt, M, Dutta, S, Wuthrich, K, Joint Center for Structural Genomics (JCSG) | Deposit date: | 2013-08-27 | Release date: | 2013-11-13 | Last modified: | 2024-05-15 | Method: | SOLUTION NMR | Cite: | NMR structure of the protein ZP_02042476.1 from Ruminococcus gnavus. To be Published
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2MXW
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![BU of 2mxw by Molmil](/molmil-images/mine/2mxw) | |
3H7H
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![BU of 3h7h by Molmil](/molmil-images/mine/3h7h) | Crystal structure of the human transcription elongation factor DSIF, hSpt4/hSpt5 (176-273) | Descriptor: | BETA-MERCAPTOETHANOL, Transcription elongation factor SPT4, Transcription elongation factor SPT5, ... | Authors: | Wenzel, S, Wohrl, B.M, Rosch, P, Martins, B.M. | Deposit date: | 2009-04-27 | Release date: | 2009-12-08 | Last modified: | 2024-03-20 | Method: | X-RAY DIFFRACTION (1.55 Å) | Cite: | Crystal structure of the human transcription elongation factor DSIF hSpt4 subunit in complex with the hSpt5 dimerization interface Biochem.J., 425, 2010
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8CAV
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![BU of 8cav by Molmil](/molmil-images/mine/8cav) | Discovery of the lanthipeptide Curvocidin and structural insights into its trifunctional synthetase CuvL | Descriptor: | (4S)-2-METHYL-2,4-PENTANEDIOL, CuvA, MAGNESIUM ION, ... | Authors: | Sigurdsson, A, Martins, B.M, Duettmann, S.A, Jasyk, M, Dimos-Roehl, B, Schoepf, F, Gemannter, M, Knittel, C.H, Schnegotyzki, R, Schmid, B, Kosol, S, Gonzalez-Viegas, M, Seidel, M, Huegelland, M, Leimkuehler, S, Dobbek, H, Mainz, A, Suessmuth, R. | Deposit date: | 2023-01-24 | Release date: | 2023-06-14 | Method: | X-RAY DIFFRACTION (2.87 Å) | Cite: | Discovery of the Lanthipeptide Curvocidin and Structural Insights into its Trifunctional Synthetase CuvL. Angew.Chem.Int.Ed.Engl., 62, 2023
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6ST5
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![BU of 6st5 by Molmil](/molmil-images/mine/6st5) | crystal structure of LicM2 | Descriptor: | GLYCEROL, LicM2, MAGNESIUM ION, ... | Authors: | Gonsior, M, Mainz, A, Hugelland, M, Kuthning, A, Tietzmann, M, Dobbek, H, Martins, B.M, Sussmuth, R. | Deposit date: | 2019-09-10 | Release date: | 2022-08-10 | Method: | X-RAY DIFFRACTION (2.82 Å) | Cite: | crystal structure of LicM2 To Be Published
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1H98
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![BU of 1h98 by Molmil](/molmil-images/mine/1h98) | New Insights into Thermostability of Bacterial Ferredoxins: High Resolution Crystal Structure of the Seven-Iron Ferredoxin from Thermus thermophilus | Descriptor: | FE3-S4 CLUSTER, FERREDOXIN, IRON/SULFUR CLUSTER | Authors: | Macedo-Ribeiro, S, Martins, B.M, Pereira, P.J.B, Buse, G, Huber, R, Soulimane, T. | Deposit date: | 2001-03-05 | Release date: | 2001-11-27 | Last modified: | 2023-12-13 | Method: | X-RAY DIFFRACTION (1.64 Å) | Cite: | New Insights Into the Thermostability of Bacterial Ferredoxins: High-Resolution Crystal Structure of the Seven-Iron Ferredoxin from Thermus Thermophilus J.Biol.Inorg.Chem., 6, 2001
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6FUY
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![BU of 6fuy by Molmil](/molmil-images/mine/6fuy) | Crystal structure of human full-length vinculin-T12-A974K (residues 1-1066) | Descriptor: | CALCIUM ION, Vinculin | Authors: | Chorev, D.S, Volberg, T, Livne, A, Eisenstein, M, Martins, B, Kam, Z, Jockusch, B.M, Medalia, O, Sharon, M, Geiger, B. | Deposit date: | 2018-02-28 | Release date: | 2018-03-14 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (3 Å) | Cite: | Conformational states during vinculin unlocking differentially regulate focal adhesion properties. Sci Rep, 8, 2018
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5L7P
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![BU of 5l7p by Molmil](/molmil-images/mine/5l7p) | In silico-powered specific incorporation of photocaged Dopa at multiple protein sites | Descriptor: | (2~{S})-2-azanyl-3-[3-[(2-nitrophenyl)methoxy]-4-oxidanyl-phenyl]propanoic acid, CALCIUM ION, CHLORIDE ION, ... | Authors: | Hauf, M, Richter, F, Schneider, T, Martins, B.M, Baumann, T, Durkin, P, Dobbek, H, Moeglich, A, Budisa, N. | Deposit date: | 2016-06-03 | Release date: | 2017-09-13 | Last modified: | 2024-01-10 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Photoactivatable Mussel-Based Underwater Adhesive Proteins by an Expanded Genetic Code. Chembiochem, 18, 2017
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1T3Q
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![BU of 1t3q by Molmil](/molmil-images/mine/1t3q) | Crystal structure of quinoline 2-Oxidoreductase from Pseudomonas Putida 86 | Descriptor: | DIOXOSULFIDOMOLYBDENUM(VI) ION, FE2/S2 (INORGANIC) CLUSTER, FLAVIN-ADENINE DINUCLEOTIDE, ... | Authors: | Bonin, I, Martins, B.M, Purvanov, V, Fetzner, S, Huber, R, Dobbek, H. | Deposit date: | 2004-04-27 | Release date: | 2004-09-14 | Last modified: | 2023-08-23 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Active site geometry and substrate recognition of the molybdenum hydroxylase quinoline 2-oxidoreductase. STRUCTURE, 12, 2004
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4AQ4
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![BU of 4aq4 by Molmil](/molmil-images/mine/4aq4) | substrate bound sn-glycerol-3-phosphate binding periplasmic protein ugpB from Escherichia coli | Descriptor: | CADMIUM ION, COBALT (II) ION, GLYCEROL, ... | Authors: | Wuttge, S, Bommer, M, Jaeger, F, Martins, B.M, Jacob, S, Licht, A, Scheffel, F, Dobbek, H, Schneider, E. | Deposit date: | 2012-04-13 | Release date: | 2012-10-17 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Determinants of Substrate Specificity and Biochemical Properties of the Sn-Glycerol-3-Phosphate ATP Binding Cassette Transporter (Ugpb-Aec(2) ) of Escherichia Coli. Mol.Microbiol., 86, 2012
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3CS6
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![BU of 3cs6 by Molmil](/molmil-images/mine/3cs6) | Structure-based design of a superagonist ligand for the vitamin D nuclear receptor | Descriptor: | (1S,3R,5Z,7E,14beta,17alpha,23R)-23-(2-hydroxy-2-methylpropyl)-20,24-epoxy-9,10-secochola-5,7,10-triene-1,3-diol, Vitamin D3 receptor | Authors: | Hourai, S, Rodriguez, L.C, Antony, P, Reina-San-Martin, B, Ciesielski, P, Magnier, B.C, Schoonjans, K, Mourino, A, Rochel, N, Moras, D. | Deposit date: | 2008-04-09 | Release date: | 2008-05-27 | Last modified: | 2024-02-21 | Method: | X-RAY DIFFRACTION (1.8 Å) | Cite: | Structure-based design of a superagonist ligand for the vitamin d nuclear receptor. Chem.Biol., 15, 2008
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3CS4
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![BU of 3cs4 by Molmil](/molmil-images/mine/3cs4) | Structure-based design of a superagonist ligand for the vitamin D nuclear receptor | Descriptor: | (1S,3R,5Z,7E,14beta,17alpha)-17-[(2S,4S)-4-(2-hydroxy-2-methylpropyl)-2-methyltetrahydrofuran-2-yl]-9,10-secoandrosta-5,7,10-triene-1,3-diol, Vitamin D3 receptor | Authors: | Hourai, S, Rodriguez, L.C, Antony, P, Reina-San-Martin, B, Ciesielski, F, Magnier, B.C, Schoonjans, K, Mourino, A, Rochel, N, Moras, D. | Deposit date: | 2008-04-09 | Release date: | 2008-05-27 | Last modified: | 2024-02-21 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Structure-based design of a superagonist ligand for the vitamin d nuclear receptor. Chem.Biol., 15, 2008
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1C56
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![BU of 1c56 by Molmil](/molmil-images/mine/1c56) | |
1C55
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![BU of 1c55 by Molmil](/molmil-images/mine/1c55) | |
1JDE
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![BU of 1jde by Molmil](/molmil-images/mine/1jde) | K22A mutant of pyruvate, phosphate dikinase | Descriptor: | PYRUVATE, PHOSPHATE DIKINASE, SULFATE ION | Authors: | Ye, D, Wei, M, McGuire, M, Huang, K, Kapadia, G, Herzberg, O, Martin, B.M, Dunaway-Mariano, D. | Deposit date: | 2001-06-13 | Release date: | 2001-11-28 | Last modified: | 2024-02-07 | Method: | X-RAY DIFFRACTION (2.8 Å) | Cite: | Investigation of the catalytic site within the ATP-grasp domain of Clostridium symbiosum pyruvate phosphate dikinase. J.Biol.Chem., 276, 2001
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