4WZA
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![BU of 4wza by Molmil](/molmil-images/mine/4wza) | Asymmetric Nucleotide Binding in the Nitrogenase Complex | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, ADENOSINE-5'-DIPHOSPHATE, FE (III) ION, ... | Authors: | Tezcan, F.A, Kaiser, J.T, Howard, J.B, Rees, D.C. | Deposit date: | 2014-11-19 | Release date: | 2014-12-31 | Last modified: | 2023-09-27 | Method: | X-RAY DIFFRACTION (1.8995 Å) | Cite: | Structural evidence for asymmetrical nucleotide interactions in nitrogenase. J.Am.Chem.Soc., 137, 2015
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4TKU
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![BU of 4tku by Molmil](/molmil-images/mine/4tku) | Reactivated Nitrogenase MoFe-protein from A. vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CHLORIDE ION, FE (II) ION, ... | Authors: | Spatzal, T, Perez, K, Einsle, O, Howard, J.B, Rees, D.C. | Deposit date: | 2014-05-27 | Release date: | 2014-10-01 | Last modified: | 2023-12-27 | Method: | X-RAY DIFFRACTION (1.43 Å) | Cite: | Ligand binding to the FeMo-cofactor: structures of CO-bound and reactivated nitrogenase. Science, 345, 2014
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4TKV
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![BU of 4tkv by Molmil](/molmil-images/mine/4tkv) | CO-bound Nitrogenase MoFe-protein from A. vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CARBON MONOXIDE, FE (II) ION, ... | Authors: | Spatzal, T, Perez, K, Einsle, O, Howard, J.B, Rees, D.C. | Deposit date: | 2014-05-28 | Release date: | 2014-10-01 | Last modified: | 2023-12-27 | Method: | X-RAY DIFFRACTION (1.5 Å) | Cite: | Ligand binding to the FeMo-cofactor: structures of CO-bound and reactivated nitrogenase. Science, 345, 2014
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6VXT
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![BU of 6vxt by Molmil](/molmil-images/mine/6vxt) | Activated Nitrogenase MoFe-protein from Azotobacter vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, FE (III) ION, FE(8)-S(7) CLUSTER, ... | Authors: | Kang, W, Hu, Y, Ribbe, M.W. | Deposit date: | 2020-02-24 | Release date: | 2020-06-24 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (1.74 Å) | Cite: | Structural evidence for a dynamic metallocofactor during N2reduction by Mo-nitrogenase. Science, 368, 2020
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6UG0
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![BU of 6ug0 by Molmil](/molmil-images/mine/6ug0) | N2-bound Nitrogenase MoFe-protein from Azotobacter vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, FE (III) ION, FE(8)-S(7) CLUSTER, ... | Authors: | Kang, W, Hu, Y, Ribbe, M.W. | Deposit date: | 2019-09-25 | Release date: | 2020-06-24 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (1.83 Å) | Cite: | Structural evidence for a dynamic metallocofactor during N2reduction by Mo-nitrogenase. Science, 368, 2020
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3U7Q
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![BU of 3u7q by Molmil](/molmil-images/mine/3u7q) | |
4XPI
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![BU of 4xpi by Molmil](/molmil-images/mine/4xpi) | Fe protein independent substrate reduction by nitrogenase variants altered in intramolecular electron transfer | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CALCIUM ION, ... | Authors: | Danyal, K, Rasmusen, A.J, Keable, S.M, Shaw, S, Zadvornyy, O, Duval, S, Dean, D.R, Raugei, S, Peters, J.W, Seefeldt, L.C. | Deposit date: | 2015-01-17 | Release date: | 2015-10-14 | Last modified: | 2023-09-27 | Method: | X-RAY DIFFRACTION (1.97 Å) | Cite: | Fe protein-independent substrate reduction by nitrogenase MoFe protein variants. Biochemistry, 54, 2015
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7AIZ
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![BU of 7aiz by Molmil](/molmil-images/mine/7aiz) | Vanadium nitrogenase VFe protein, high CO state | Descriptor: | 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-HYDROXY-3-CARBOXY-ADIPIC ACID, ... | Authors: | Rohde, M, Einsle, O. | Deposit date: | 2020-09-28 | Release date: | 2021-06-09 | Last modified: | 2024-01-31 | Method: | X-RAY DIFFRACTION (1.05 Å) | Cite: | Two ligand-binding sites in CO-reducing V nitrogenase reveal a general mechanistic principle. Sci Adv, 7, 2021
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7JRF
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![BU of 7jrf by Molmil](/molmil-images/mine/7jrf) | CO-CO-BOUND NITROGENASE MOFE-PROTEIN FROM A. VINELANDII | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CALCIUM ION, CARBON MONOXIDE, ... | Authors: | Spatzal, T, Perez, K.A, Buscagan, T.M, Maggiolo, A.O, Rees, D.C. | Deposit date: | 2020-08-12 | Release date: | 2021-03-24 | Last modified: | 2023-10-18 | Method: | X-RAY DIFFRACTION (1.33 Å) | Cite: | Structural Characterization of Two CO Molecules Bound to the Nitrogenase Active Site. Angew.Chem.Int.Ed.Engl., 60, 2021
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3K1A
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![BU of 3k1a by Molmil](/molmil-images/mine/3k1a) | Insights into substrate binding at FeMo-cofactor in nitrogenase from the structure of an alpha-70Ile MoFe protein variant | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CALCIUM ION, FE(7)-MO-S(9)-N CLUSTER, ... | Authors: | Peters, J.W, Sarma, R, Barney, B.M, Keable, S, Seefeldt, L.C, Dean, D.R. | Deposit date: | 2009-09-26 | Release date: | 2010-02-16 | Last modified: | 2023-09-06 | Method: | X-RAY DIFFRACTION (2.23 Å) | Cite: | Insights into substrate binding at FeMo-cofactor in nitrogenase from the structure of an alpha-70(Ile) MoFe protein variant J.Inorg.Biochem., 104, 2010
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4WZB
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![BU of 4wzb by Molmil](/molmil-images/mine/4wzb) | Crystal Structure of MgAMPPCP-bound Av2-Av1 complex | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, FE (II) ION, FE(8)-S(7) CLUSTER, ... | Authors: | Tezcan, F.A, Kaiser, J.T, Mustafi, D, Walton, M.Y, Howard, J.B, Rees, D.C. | Deposit date: | 2014-11-19 | Release date: | 2015-02-25 | Last modified: | 2024-02-28 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Nitrogenase complexes: multiple docking sites for a nucleotide switch protein. Science, 309, 2005
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2C8V
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![BU of 2c8v by Molmil](/molmil-images/mine/2c8v) | Insights into the role of nucleotide-dependent conformational change in nitrogenase catalysis: Structural characterization of the nitrogenase Fe protein Leu127 deletion variant with bound MgATP | Descriptor: | ADENOSINE-5'-TRIPHOSPHATE, FE2/S2 (INORGANIC) CLUSTER, MAGNESIUM ION, ... | Authors: | Sen, S, Krishnakumar, A, McClead, J, Johnson, M.K, Seefeldt, L.C, Szilagyi, R.K, Peters, J.W. | Deposit date: | 2005-12-08 | Release date: | 2006-06-01 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (2.5 Å) | Cite: | Insights Into the Role of Nucleotide-Dependent Conformational Change in Nitrogenase Catalysis: Structural Characterization of the Nitrogenase Fe Protein Leu127 Deletion Variant with Bound Mgatp. J.Inorg.Biochem., 100, 2006
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4WN9
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![BU of 4wn9 by Molmil](/molmil-images/mine/4wn9) | Structure of the Nitrogenase MoFe Protein from Clostridium pasteurianum Pressurized with Xenon | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, FE (III) ION, FE(8)-S(7) CLUSTER, ... | Authors: | Morrison, C.N, Hoy, J.A, Rees, D.C. | Deposit date: | 2014-10-11 | Release date: | 2015-03-18 | Last modified: | 2023-12-27 | Method: | X-RAY DIFFRACTION (1.9 Å) | Cite: | Substrate Pathways in the Nitrogenase MoFe Protein by Experimental Identification of Small Molecule Binding Sites. Biochemistry, 54, 2015
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4WNA
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![BU of 4wna by Molmil](/molmil-images/mine/4wna) | Structure of the Nitrogenase MoFe Protein from Azotobacter vinelandii Pressurized with Xenon | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, FE (III) ION, FE(8)-S(7) CLUSTER, ... | Authors: | Morrison, C.N, Hoy, J.A, Zhang, L, Einsle, O, Rees, D.C. | Deposit date: | 2014-10-11 | Release date: | 2015-03-18 | Last modified: | 2023-12-27 | Method: | X-RAY DIFFRACTION (2 Å) | Cite: | Substrate Pathways in the Nitrogenase MoFe Protein by Experimental Identification of Small Molecule Binding Sites. Biochemistry, 54, 2015
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5BVH
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![BU of 5bvh by Molmil](/molmil-images/mine/5bvh) | CO-bound form of Selenium incorporated nitrogenase MoFe-protein (Av1-Se-CO) from A. vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CARBON MONOXIDE, CHLORIDE ION, ... | Authors: | Spatzal, T, Perez, K.A, Howard, J.B, Rees, D.C. | Deposit date: | 2015-06-05 | Release date: | 2015-12-30 | Last modified: | 2017-11-22 | Method: | X-RAY DIFFRACTION (1.53 Å) | Cite: | Catalysis-dependent selenium incorporation and migration in the nitrogenase active site iron-molybdenum cofactor. Elife, 4, 2015
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8Q5V
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![BU of 8q5v by Molmil](/molmil-images/mine/8q5v) | |
8Q5X
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![BU of 8q5x by Molmil](/molmil-images/mine/8q5x) | |
8Q5W
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![BU of 8q5w by Molmil](/molmil-images/mine/8q5w) | |
2AFI
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![BU of 2afi by Molmil](/molmil-images/mine/2afi) | Crystal Structure of MgADP bound Av2-Av1 Complex | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, ADENOSINE-5'-DIPHOSPHATE, CALCIUM ION, ... | Authors: | Tezcan, F.A, Kaiser, J.T, Mustafi, D, Walton, M.Y, Howard, J.B, Rees, D.C. | Deposit date: | 2005-07-25 | Release date: | 2005-09-06 | Last modified: | 2023-08-23 | Method: | X-RAY DIFFRACTION (3.1 Å) | Cite: | Nitrogenase Complexes: Multiple Docking Sites for a Nucleotide Switch Protein Science, 309, 2005
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2AFH
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![BU of 2afh by Molmil](/molmil-images/mine/2afh) | Crystal Structure of Nucleotide-Free Av2-Av1 Complex | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CALCIUM ION, ... | Authors: | Tezcan, F.A, Kaiser, J.T, Mustafi, D, Walton, M.Y, Howard, J.B, Rees, D.C. | Deposit date: | 2005-07-25 | Release date: | 2005-09-06 | Last modified: | 2023-08-23 | Method: | X-RAY DIFFRACTION (2.1 Å) | Cite: | Nitrogenase Complexes: Multiple Docking Sites for a Nucleotide Switch Protein Science, 309, 2005
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5BVG
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![BU of 5bvg by Molmil](/molmil-images/mine/5bvg) | Selenium incorporated nitrogenase MoFe-protein (Av1-Se2B) from A. vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CHLORIDE ION, FE (II) ION, ... | Authors: | Spatzal, T, Perez, K.A, Howard, J.B, Rees, D.C. | Deposit date: | 2015-06-05 | Release date: | 2015-12-30 | Last modified: | 2023-09-27 | Method: | X-RAY DIFFRACTION (1.6 Å) | Cite: | Catalysis-dependent selenium incorporation and migration in the nitrogenase active site iron-molybdenum cofactor. Elife, 4, 2015
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8TC3
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![BU of 8tc3 by Molmil](/molmil-images/mine/8tc3) | |
7JMB
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![BU of 7jmb by Molmil](/molmil-images/mine/7jmb) | Crystal structure of Nitrogenase iron-molybdenum cofactor biosynthesis enzyme NifB from Methanothermobacter thermautotrophicus with three Fe4S4 clusters | Descriptor: | IRON/SULFUR CLUSTER, Nitrogenase iron-molybdenum cofactor biosynthesis protein NifB | Authors: | Kang, W, Rettberg, L, Ribbe, M.W, Hu, Y. | Deposit date: | 2020-07-31 | Release date: | 2020-10-28 | Last modified: | 2023-10-18 | Method: | X-RAY DIFFRACTION (3 Å) | Cite: | X-Ray Crystallographic Analysis of NifB with a Full Complement of Clusters: Structural Insights into the Radical SAM-Dependent Carbide Insertion During Nitrogenase Cofactor Assembly. Angew.Chem.Int.Ed.Engl., 60, 2021
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1DE0
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![BU of 1de0 by Molmil](/molmil-images/mine/1de0) | |
6OP4
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![BU of 6op4 by Molmil](/molmil-images/mine/6op4) | Selenium-incorporated, carbon monoxide-inhibited, reactivated FeMo-cofactor of nitrogenase from Azotobacter vinelandii | Descriptor: | 3-HYDROXY-3-CARBOXY-ADIPIC ACID, CALCIUM ION, FE(8)-S(7) CLUSTER, ... | Authors: | Arias, R.J, Rees, D.C. | Deposit date: | 2019-04-24 | Release date: | 2019-08-14 | Last modified: | 2023-10-11 | Method: | X-RAY DIFFRACTION (2.3 Å) | Cite: | Localized Electronic Structure of Nitrogenase FeMoco Revealed by Selenium K-Edge High Resolution X-ray Absorption Spectroscopy. J.Am.Chem.Soc., 141, 2019
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