Fluorine in PDB, part 142 (files: 5641-5680),
PDB 6fex-6g0f
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: 5641-5680 (PDB 6fex-6g0f).
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6fex (F: 3) - DDR1, 2-[4-Bromo-2-Oxo-1'-(1H-Pyrazolo[4,3-B]Pyridine-5-Carbonyl) Spiro[Indole-3,4'-Piperidine]-1-Yl]-N-(2,2,2-Trifluoroethyl) Acetamide, 1.291A, P212121, Rfree=17.4%
Other atoms:
Br (1);
I (4);
Cl (4);
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6ffb (F: 1) - 17BETA-Hydroxysteroid Dehydrogenase 14 Variant S205 - Mutant Q148A - in Complex with A Nonsteroidal Inhibitor
Other atoms:
Na (1);
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6ffn (F: 1) - Structure-Based Design and Synthesis of Macrocyclic Human Rhinovirus 3C Protease Inhibitors
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6ffs (F: 2) - Structure-Based Design and Synthesis of Macrocyclic Human Rhinovirus 3C Protease Inhibitors
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6fgf (F: 1) - Crystal Structure of BAZ2A Bromodomain in Complex with 1- Methylpyridinone Compound 2
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6fh7 (F: 1) - Crystal Structure of BAZ2B Bromodomain in Complex with 1- Methylpyridinone Compound 2
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6fio (F: 3) - DDR1, 2-[1'-(1H-Indazole-5-Carbonyl)-4-Methyl-2-Oxospiro[Indole-3,4'- Piperidine]-1-Yl]-N-(2,2,2-Trifluoroethyl)Acetamide, 1.990A, P6522, Rfree=27.7%
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6fiq (F: 3) - DDR1, 1-(1H-Indazole-5-Carbonyl)-5'-Methoxy-1'-[2-Oxo-2-[(2S)-2- (Trifluoromethyl)Pyrrolidin-1-Yl]Ethyl]Spiro[Piperidine-4,3'- Pyrrolo[3,2-B]Pyridine]-2'-One, 1.790A, P212121, Rfree=23.8%
Other atoms:
Cl (1);
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6fmd (F: 4) - Targeting Myeloid Differentiation Using Potent Human Dihydroorotate Dehydrogenase (Hdhodh) Inhibitors Based on 2-Hydroxypyrazolo[1,5- A]Pyridine Scaffold
Other atoms:
Cl (2);
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6fmf (F: 3) - Neuropilin-1 B1 Domain in Complex with EG01377; 2.8 Angstrom Structure
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6fn1 (F: 4) - Zosuquidar and UIC2 Fab Complex of Human-Mouse Chimeric ABCB1 (ABCB1HM)
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6fne (F: 3) - Structure of BRAG2
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6fnf (F: 3) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with Nvp-BHG712
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6fng (F: 3) - Crystal Structure of Ephrin A2 (EPHA2) Receptor Protein Kinase with An Isomer of Nvp-BHG712
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6fni (F: 3) - Crystal Structure of Ephrin B4 (EPHB4) Receptor Protein Kinase with Nvp-BHG712
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6fnj (F: 6) - Crystal Structure of Ephrin B4 (EPHB4) Receptor Protein Kinase with An Isomer of Nvp-BHG712
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6fo0 (F: 6) - Cryoem Structure of Bovine Cytochrome BC1 in Complex with the Anti- Malarial Compound GSK932121
Other atoms:
Fe (6);
Cl (2);
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6fo6 (F: 6) - Cryoem Structure of Bovine Cytochrome BC1 in Complex with the Anti- Malarial Inhibitor SCR0911
Other atoms:
Fe (6);
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6fqj (F: 24) - GLUA2(Flop) G724C Ligand Binding Core Dimer Bound to ZK200775 at 2.50 Angstrom Resolution
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6fqk (F: 6) - GLUA2(Flop) S729C Ligand Binding Core Dimer Bound to ZK200775 at 1.98 Angstrom Resolution
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6fqm (F: 7) - 3.06A Complex of S.Aureus Gyrase with Imidazopyrazinone T1 and Dna
Other atoms:
Mn (4);
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6fqs (F: 3) - 3.11A Complex of S.Aureus Gyrase with Imidazopyrazinone T3 and Dna
Other atoms:
Mn (2);
Na (1);
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6fqu (F: 2) - Crystal Structure of Crebbp Bromodomain Complexd with DR09
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6fr2 (F: 3) - Soluble Epoxide Hydrolase in Complex with LK864
Other atoms:
Mg (1);
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6fs6 (F: 12) - Influenza A/California/04/2009 (PH1N1) Endonuclease with Bound Inhibitor, Baloxavir Acid (Bxa)
Other atoms:
Mn (12);
-
6fs7 (F: 12) - Influenza A/California/04/2009 (PH1N1) Endonuclease with I38T Mutation with Bound Inhibitor, Baloxavir Acid (Bxa)
Other atoms:
Mn (12);
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6fs8 (F: 4) - Influenza B/Memphis/13/03 Endonuclease with Bound Inhibitor, Baloxavir Acid (Bxa)
Other atoms:
Mn (4);
-
6fs9 (F: 2) - Influenza B/Memphis/13/03 Endonuclease with I38T Mutation with Bound Inhibitor, Baloxavir Acid (Bxa)
Other atoms:
Mn (2);
Cl (2);
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6ft4 (F: 2) - Crystal Structure of the First Bromodomain of Human BRD4 in Complex with A 3,5-Dimethylisoxazol Ligand
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6ftx (F: 3) - Structure of the Chromatin Remodelling Enzyme CHD1 Bound to A Ubiquitinylated Nucleosome
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6fvf (F: 1) - The Structure of CK2ALPHA with CCH503 Bound
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6fw7 (F: 2) - Crystal Structure of L-Tryptophan Oxidase Vioa From Chromobacterium Violaceum in Complex with 4-Fluoro-L-Tryptophan
Other atoms:
Mg (2);
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6fw9 (F: 3) - Crystal Structure of L-Tryptophan Oxidase Vioa From Chromobacterium Violaceum in Complex with 6-Fluoro-L-Tryptophan
Other atoms:
Mg (2);
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6fwc (F: 2) - Crystal Structure of Human Monoamine Oxidase B (Mao B) in Complex with Fluorophenyl-Chromone-Carboxamide
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6fws (F: 6) - Structure of Ding in Complex with Ssdna and Adpbef
Other atoms:
Mg (2);
Fe (8);
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6fyz (F: 3) - Development and Characterization of A Cns-Penetrant Benzhydryl Hydroxamic Acid Class Iia Histone Deacetylase Inhibitor
Other atoms:
Zn (6);
Na (3);
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6fz4 (F: 4) - Structure of GLUK1 Ligand-Binding Domain in Complex with N-(7-Fluoro- 2,3-Dioxo-6-(Trifluoromethyl)-3,4-Dihydroquinoxalin-1(2H)-Yl)-2- Hydroxybenzamide at 1.85 A Resolution
Other atoms:
Cl (1);
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6fzq (F: 2) - Crystal Structure of Scfv-SM3 in Complex with Compound 3
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6fzr (F: 1) - Crystal Structure of Scfv-SM3 in Complex with Compound 2
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6g0f (F: 1) - BRD4 (BD1) in Complex with Docking-Derived Ligand
Other atoms:
Br (1);
Page generated: Sun Dec 15 10:25:53 2024
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