Fluorine in PDB, part 193 (files: 7681-7720),
PDB 7l9m-7lry
Experimental structures of coordination spheres of Fluorine (F) in bioorganic
molecules from X-Ray and NMR experiments. Coordination spheres were calculated with 5.0 Angstroms radius
around Fluorine atoms. PDB files: 7681-7720 (PDB 7l9m-7lry).
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7l9m (F: 2) - Crystal Structure of the First Bromodomain (BD1) of Human BRD4 in Complex with Bivalent Inhibitor Gxh-II-083
Other atoms:
Cl (2);
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7l9y (F: 4) - Human PARP14 (ARTD8), Catalytic Fragment in Complex with RBN012042
Other atoms:
Cl (5);
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7lad (F: 1) - Clobetasol Propionate Bound to CYP3A5
Other atoms:
Cl (1);
Fe (1);
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7lae (F: 2) - Crystal Structure of Myeloperoxidase Subform C (Mpo) Complex with Compound-4
Other atoms:
Cl (2);
Ca (2);
Fe (2);
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7laj (F: 2) - Crystal Structure of the First Bromodomain (BD1) of Human BRD2 Bound to RO3280
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7lay (F: 2) - Crystal Structure of the First Bromodomain (BD1) of Human BRD3 Bound to SG3-179
Other atoms:
Cl (2);
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7lcd (F: 1) - Crystal Structure of Human Polymerase Eta Complexed with Syn N7- Acetophenoneguanine
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7lci (F: 1) - Pf 06882961 Bound to the Glucagon-Like Peptide-1 Receptor (Glp-1R):Gs Complex
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7lcj (F: 1) - Pf 06882961 Bound to the Glucagon-Like Peptide-1 Receptor (Glp-1R):Gs Complex
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7lck (F: 1) - Pf 06882961 Bound to the Glucagon-Like Peptide-1 Receptor (Glp-1R)
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7lcm (F: 3) - Receiver Domain of Rssb Bound to Beryllofluoride
Other atoms:
Mg (1);
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7lco (F: 1) - Improved Feline Drugs As Sars-Cov-2 Mpro Inhibitors: Structure- Activity Studies & Micellar Solubilization For Enhanced Bioavailability
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7lcr (F: 2) - Improved Feline Drugs As Sars-Cov-2 Mpro Inhibitors: Structure- Activity Studies & Micellar Solubilization For Enhanced Bioavailability
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7ld3 (F: 6) - Cryo-Em Structure of the Human Adenosine A1 Receptor-GI2-Protein Complex Bound to Its Endogenous Agonist and An Allosteric Ligand
Other atoms:
Cl (1);
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7ldd (F: 18) - Native Ampa Receptor
Other atoms:
Cl (2);
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7lde (F: 18) - Native Ampa Receptor
Other atoms:
Cl (2);
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7lep (F: 18) - The Composite Lbd-Tmd Structure Combined From All Hippocampal Ampar Subtypes at 3.25 Angstrom Resolution
Other atoms:
Cl (2);
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7lg8 (F: 4) - Egfr (T79M/V948R) in Complex with Naquotinib and An Allosteric Inhibitor
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7lgk (F: 6) - Crystal Structure of Soluble Guanylate Cyclase Activator Runcaciguat (Bay 1101042) Bound to Nostoc H-Nox Domain
Other atoms:
Cl (6);
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7lgx (F: 3) - The Aminoacrylate Form of Mutant Beta-K167T Salmonella Typhimurium Tryptophan Synthase in Complex with with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site, Benzimidazole (Bzi) at the Enzyme Beta Site and Cesium Ion at the Metal Coordination Site at 1.80 Angstrom Resolution
Other atoms:
Cs (3);
Cl (4);
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7lh7 (F: 6) - Crystal Structure of Bcl-Xl in Complex with A Benzothiazole-Based Inhibitor
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7lhz (F: 4) - K. Pneumoniae Topoisomerase IV (Pare-Parc) in Complex with Dna and (3S)-10-[(3R)-3-(1-Aminocyclopropyl)Pyrrolidin-1-Yl]-9-Fluoro-3- Methyl-5-Oxo-2,3-Dihydro-5H-[1,4]Oxazino[2,3,4-Ij]Quinoline-6- Carboxylic Acid (Compound 25)
Other atoms:
Mg (4);
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7li5 (F: 6) - Crystal Structure Analysis of Human TEAD1
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7liu (F: 6) - DDX3X Bound to Atp Analog and Remodeled Rna:Dna Hybrid
Other atoms:
Mg (2);
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7lje (F: 20) - Discovery of Spirohydantoins As Selective, Orally Bioavailable Inhibitors of P300/Cbp Histone Acetyltransferases
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7lk1 (F: 5) - Ornithine Aminotransferase (Oat) with Its Potent Inhibitor - (S)-3- Amino-4,4-Difluorocyclopent-1-Enecarboxylic Acid (Ss-1-148) - 1 Hour Soaking
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7lkl (F: 3) - The Internal Aldimine Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site, Cesium Ion at the Metal Coordination Site and the Product L-Tryptophan at the Enzyme Beta-Site at 1.05 Angstrom Resolution. One of the Beta-Q114 Rotamer Conformations Allows A Hydrogen Bond to Form with the Plp Oxygen at the Position 3 in the Ring
Other atoms:
Cs (8);
Cl (4);
-
7ll4 (F: 1) - High-Resolution Crystal Structure of Human JAK2 Kinase Domain (JH1) Bound to PN5-114.
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7lo6 (F: 3) - Structure of CD4 Mimetic Bnm-III-170 in Complex with BG505 Sosip.664 Hiv-1 Env Trimer and 17B Fab
Other atoms:
Cl (3);
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7loa (F: 1) - T4 Lysozyme Mutant L99A in Complex with 3-Fluoroiodobenzene
Other atoms:
I (1);
-
7lob (F: 1) - T4 Lysozyme Mutant L99A in Complex with 1-Fluoro-2-[(Prop-2-En-1-Yl) Oxy]Benzene
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7loc (F: 1) - T4 Lysozyme Mutant L99A in Complex with 1-Bromanyl-4-Fluoranyl-Benzene
Other atoms:
Br (1);
-
7lod (F: 1) - T4 Lysozyme Mutant L99A in Complex with 1-Fluoranyl-4-Iodanyl-Benzene
Other atoms:
I (1);
-
7loe (F: 2) - T4 Lysozyme Mutant L99A in Complex with 1-Fluoranylnaphthalene
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7lom (F: 1) - Ornithine Aminotransferase (Oat) Soaked with Its Inactivator - (1S, 3S)-3-Amino-4-(Difluoromethylene)Cyclohexene-1-Carboxylic Acid
-
7lpf (F: 3) - The Internal Aldimine Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with Inhibitor N-(4'- Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) at the Enzyme Alpha-Site and Sodium Ion at the Metal Coordination Site at 1.10 Angstrom Resolution
Other atoms:
Na (1);
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7lpw (F: 4) - Crystal Structure of Hiv-1 Rt in Complex with Nbd-14189
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7lpx (F: 3) - Crystal Structure of Hiv-1 Rt in Complex with Nbd-14270
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7lqu (F: 1) - Crystal Structure of Hiv-1 Rt in Complex with Nbd-14075
Other atoms:
Cl (1);
-
7lry (F: 2) - Structure of Hiv-1 Reverse Transcriptase in Complex with Dna, (-)Ftc- Tp, and Ca(2+) Ion
Other atoms:
Ca (2);
Page generated: Thu Dec 28 04:16:39 2023
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