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7LAL	CRYSTAL STRUCTURE OF MYELOPEROXIDASE SUBFORM C (MPO) COMPLEX WITH COMPOUND-18 AKA 7-(3-(2,3-DIHYDRO-1H-INDEN-1-YLAMINO)-1-PHENYLPROPYL)-1H-[1,2,3]TRIAZOLO[4,5-B]PYRIDIN-5-AMINE Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 7-[(1R)-3-{[(1R)-2,3-dihydro-1H-inden-1-yl]amino}-1-phenylpropyl]-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine, ... Authors: Khan, J.A. Deposit date: 2021-01-06 Release date: 2021-04-21 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.75 Å) Cite: Small molecule and macrocyclic pyrazole derived inhibitors of myeloperoxidase (MPO). Bioorg.Med.Chem.Lett., 42, 2021
5F5X	Crystal structure of S116A Ba3275 with AMP bound Descriptor: ADENOSINE MONOPHOSPHATE, MccC family protein Ba3275 Authors: Nocek, B, Severinov, K, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) Deposit date: 2015-12-04 Release date: 2015-12-30 Last modified: 2017-02-08 Method: X-RAY DIFFRACTION (2.006 Å) Cite: Crystal structure of Ba3275-AMP complex from Bacillus cereus ATCC 10987 To Be Published
4S2M	Crystal Structure of OXA-163 complexed with iodide in the active site Descriptor: Beta-lactamase, IODIDE ION Authors: Stojanoski, V, Hu, L, Palzkill, T.G, Prasad, B. Deposit date: 2015-01-21 Release date: 2015-07-22 Last modified: 2023-09-20 Method: X-RAY DIFFRACTION (2.87 Å) Cite: Structural Basis for Different Substrate Profiles of Two Closely Related Class D beta-Lactamases and Their Inhibition by Halogens. Biochemistry, 54, 2015
6BRI	RHCC with unreduced and reduced Mercury complexes Descriptor: GLYCEROL, IODIDE ION, MERCURY (II) IODIDE, ... Authors: McDougall, M, Trieu, B, Stetefeld, J. Deposit date: 2017-11-30 Release date: 2018-02-07 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (3.266 Å) Cite: Reductive power of the archaea right-handed coiled coil nanotube (RHCC-NT) and incorporation of mercury clusters inside protein cages. J. Struct. Biol., 203, 2018
1C6N	T4 LYSOZYME MUTANT C54T/C97A/L99A/F153A IN THE PRESENCE OF 8 ATM XENON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME), ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
8GTY	Crystal structure of exopolyphosphatase (PPX) from Zymomonas mobilis in complex with magnesium ions Descriptor: MAGNESIUM ION, Ppx/GppA phosphatase Authors: Lu, Z, Wang, J, Zhang, B. Deposit date: 2022-09-09 Release date: 2023-09-13 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Structure of the exopolyphosphatase (PPX) from Zymomonas mobilis reveals a two-magnesium-ions PPX. Int.J.Biol.Macromol., 262, 2024
1C66	T4 LYSOZYME MUTANT C54T/C97A/L121A/L133A IN THE PRESENCE OF 8 ATM ARGON Descriptor: ARGON, BETA-MERCAPTOETHANOL, CHLORIDE ION, ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1BLX	P19INK4D/CDK6 COMPLEX Descriptor: CALCIUM ION, CYCLIN-DEPENDENT KINASE 6, P19INK4D Authors: Brotherton, D.H, Dhanaraj, V, Wick, S, Brizuela, L, Domaille, P.J, Volyanik, E, Xu, X, Parisini, E, Smith, B.O, Archer, S.J, Serrano, M, Brenner, S.L, Blundell, T.L, Laue, E.D. Deposit date: 1998-07-21 Release date: 1999-06-01 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Crystal structure of the complex of the cyclin D-dependent kinase Cdk6 bound to the cell-cycle inhibitor p19INK4d. Nature, 395, 1998
6N3X	Human Histidine Triad Nucleotide Binding Protein 1 (Hint1) with Bound 5'-O-[1-Benzyl]Carbamoyl Guanosine Descriptor: 1,2-ETHANEDIOL, 5'-O-(benzylcarbamoyl)guanosine, CHLORIDE ION, ... Authors: Strom, A.M, Finzel, B.C. Deposit date: 2018-11-16 Release date: 2019-09-18 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.1 Å) Cite: Inhibition of HINT1 Modulates Spinal Nociception and NMDA Evoked Behavior in Mice. Acs Chem Neurosci, 10, 2019
5J3R	Crystal structure of yeast monothiol glutaredoxin Grx6 in complex with a glutathione-coordinated [2Fe-2S] cluster Descriptor: FE2/S2 (INORGANIC) CLUSTER, GLUTATHIONE, Monothiol glutaredoxin-6 Authors: Abdalla, M, Dai, Y.-N, Chi, C.-B, Cheng, W, Cao, D.-D, Zhou, K, Ali, W, Chen, Y, Zhou, C.-Z. Deposit date: 2016-03-31 Release date: 2016-10-19 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.46 Å) Cite: Crystal structure of yeast monothiol glutaredoxin Grx6 in complex with a glutathione-coordinated [2Fe-2S] cluster Acta Crystallogr.,Sect.F, 72, 2016
4RKN	Wolinella succinogenes octaheme sulfite reductase MccA, form II Descriptor: COPPER (II) ION, DITHIONITE, MccA, ... Authors: Hermann, B, Kern, M, La Pietra, L, Simon, J, Einsle, O. Deposit date: 2014-10-13 Release date: 2015-02-04 Last modified: 2017-11-22 Method: X-RAY DIFFRACTION (2.1 Å) Cite: The octahaem MccA is a haem c-copper sulfite reductase. Nature, 520, 2015
1C61	T4 LYSOZYME MUTANT C54T/C97A/F153A IN THE PRESENCE OF 8 ATM KRYPTON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, KRYPTON, ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C60	T4 LYSOZYME MUTANT C54T/C97A/F153A IN THE PRESENCE OF 8 ATM ARGON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME) Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C62	T4 LYSOZYME MUTANT C54T/C97A/F153A IN THE PRESENCE OF 8 ATM XENON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME), ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C65	T4 LYSOZYME MUTANT C54T/C97A/L121A IN THE PRESENCE OF 8 ATM XENON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME), ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
5B8A	Crystal structure of oxidized chimeric EcAhpC1-186-YFSKHN Descriptor: Alkyl hydroperoxide reductase subunit C,Peroxiredoxin-2, GLYCEROL, SULFATE ION Authors: Kamariah, N, Sek, M.F, Eisenhaber, B, Eisenhaber, F, Gruber, G. Deposit date: 2016-06-14 Release date: 2017-02-01 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Transition steps in peroxide reduction and a molecular switch for peroxide robustness of prokaryotic peroxiredoxins. Sci Rep, 6, 2016
1C67	T4 LYSOZYME MUTANT C54T/C97A/L121A/L133A IN THE PRESENCE OF 8 ATM KRYPTON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, KRYPTON, ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
6UOL	Y271G DNA polymerase beta substrate complex with a templating cytosine and incoming rGTP Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, DNA (5'-D(*CP*CP*GP*AP*CP*CP*GP*CP*GP*CP*AP*TP*CP*AP*GP*C)-3'), ... Authors: Smith, M.R, Freudenthal, B.D. Deposit date: 2019-10-15 Release date: 2020-01-08 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.936 Å) Cite: Molecular and structural characterization of oxidized ribonucleotide insertion into DNA by human DNA polymerase beta. J.Biol.Chem., 295, 2020
1C64	T4 LYSOZYME MUTANT C54T/C97A/L121A IN THE PRESENCE OF 8 ATM KRYPTON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, KRYPTON, ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C69	T4 LYSOZYME MUTANT C54T/C97A/L133A IN THE PRESENCE OF 8 ATM ARGON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME) Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C6B	T4 LYSOZYME MUTANT C54T/C97A/L133A IN THE PRESENCE OF 8 ATM XENON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME), ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C63	T4 LYSOZYME MUTANT C54T/C97A/L121A IN THE PRESENCE OF 8 ATM ARGON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME) Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
1C68	T4 LYSOZYME MUTANT C54T/C97A/L121A/L133A IN THE PRESENCE OF 8 ATM XENON Descriptor: BETA-MERCAPTOETHANOL, CHLORIDE ION, PROTEIN (LYSOZYME), ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000
7KEJ	BDBV-289 bound to EBOV GPdMuc Makona Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Antibody Fab heavy chain (HC) BDBV-289, Antibody Fab light chain (LC) BDBV-289, ... Authors: Murin, C.D, Ward, A.B. Deposit date: 2020-10-11 Release date: 2021-06-23 Method: ELECTRON MICROSCOPY (3.8 Å) Cite: Convergence of a common solution for broad ebolavirus neutralization by glycan cap-directed human antibodies. Cell Rep, 35, 2021
1C6C	T4 LYSOZYME MUTANT C54T/C97A/L99A IN THE PRESENCE OF 16 ATM ARGON Descriptor: ARGON, BETA-MERCAPTOETHANOL, CHLORIDE ION, ... Authors: Quillin, M.L, Matthews, B.W. Deposit date: 1999-12-21 Release date: 2000-10-04 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Size versus polarizability in protein-ligand interactions: binding of noble gases within engineered cavities in phage T4 lysozyme. J.Mol.Biol., 302, 2000

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