Fluorine in PDB, part 85 (files: 3361-3400),
PDB 4x7j-4xxs
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: 3361-3400 (PDB 4x7j-4xxs).
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4x7j (F: 3) - Co-Crystal Structure of Perk with 2-Amino-N-[4-Methoxy-3- (Trifluoromethyl)Phenyl]-4-Methyl-3-[2-(Methylamino)Quinazolin-6- Yl]Benzamide Inhibitor
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4x7k (F: 1) - Co-Crystal Structure of Perk Bound to 4-{2-Amino-3-[5-Fluoro-2- (Methylamino)Quinazolin-6-Yl]-4-Methylbenzoyl}-1-Methyl-2,5-Diphenyl- 1,2-Dihydro-3H-Pyrazol-3-One Inhibitor
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4x7o (F: 4) - Co-Crystal Structure of Perk Bound to 1-[5-(4-Amino-2,7-Dimethyl-7H- Pyrrolo[2,3-D]Pyrimidin-5-Yl)-2,3-Dihydro-1H-Indol-1-Yl]-2-[3-Fluoro- 5-(Trifluoromethyl)Phenyl]Ethanone Inhibitor
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4x7q (F: 4) - PIM2 Kinase in Complex with Compound 1S
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4xdk (F: 24) - Crystal Structure of Human Two Pore Domain Potassium Ion Channel TREK2 (K2P10.1) in Complex with Norfluoxetine
Other atoms:
K (6);
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4xdl (F: 12) - Crystal Structure of Human Two Pore Domain Potassium Ion Channel TREK2 (K2P10.1) in Complex with A Brominated Fluoxetine Derivative.
Other atoms:
K (6);
Cd (2);
Br (4);
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4xe0 (F: 1) - Idelalisib Bound to the P110 Subunit of PI3K Delta
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4xe5 (F: 3) - Crystal Structure of the Na,K-Atpase From Bovine
Other atoms:
Mg (3);
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4xew (F: 2) - Crystal Structure of 7,8-Diaminopelargonic Acid Synthase (Bioa) From Mycobacterium Tuberculosis, Complexed with A Hts Lead Compound
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4xg3 (F: 2) - Crystal Structure of An Inhibitor-Bound Syk
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4xg4 (F: 1) - Crystal Structure of An Inhibitor-Bound Syk
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4xhk (F: 2) - PIM1 Kinase in Complex with Compound 1S
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4xj0 (F: 2) - Crystal Structure of ERK2 in Complex with An Inhibitor 14K
Other atoms:
Cl (2);
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4xja (F: 2) - Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 5-Acetamido-2,3-Difluoro-3-Hydroxy-6-[1,2,3- Trihydroxypropyl]Oxane-2-Carboxylic Acid
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4xjr (F: 2) - The Catalytic Mechanism of Human Parainfluenza Virus Type 3 Haemagglutinin-Neuraminidase Revealed
Other atoms:
Ca (2);
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4xjs (F: 1) - Human CD38 Complexed with Inhibitor 1 [6-Fluoro-2-Methyl-4-[(2,3,6- Trichlorobenzyl)Amino]Quinoline-8-Carboxamide]
Other atoms:
Cl (3);
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4xju (F: 1) - Crystal Structure of the Nanb Sialidase From Streptococcus Pneumoniae in Complex with 4-Acetamido-2-Fluoro-3-Hydroxy-6-[1,2- Dihydroxyethyl]-7,8-Dioxabicyclo[3.2.1]Octane-1-Carboxylic Acid
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4xkx (F: 2) - Crystal Structure of BACE1 in Complex with 2-Aminooxazoline 3- Azaxanthene Inhibitor 28
Other atoms:
I (4);
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4xm6 (F: 1) - Anthrax Toxin Lethal Factor with Ligand-Induced Binding Pocket
Other atoms:
Zn (1);
-
4xm7 (F: 1) - Anthrax Toxin Lethal Factor with Ligand-Induced Binding Pocket
Other atoms:
Zn (1);
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4xmo (F: 2) - Crystal Structure of C-Met in Complex with (R)-5-(8-Fluoro-3-(1- Fluoro-1-(3-Methoxyquinolin-6-Yl)Ethyl)-[1,2,4]Triazolo[4,3- A]Pyridin-6-Yl)-3-Methylisoxazole
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4xnv (F: 3) - The Human P2Y1 Receptor in Complex with Bptu
Other atoms:
Zn (1);
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4xpg (F: 1) - X-Ray Structure of Drosophila Dopamine Transporter with Subsiteb Mutations (D121G/S426M) Bound to Beta-Cft or WIN35428
Other atoms:
Cl (1);
Na (2);
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4xpz (F: 3) - Structure of Fission Yeast Rna Polymerase II Ctd Phosphatase FCP1- R271A Bound to Aluminum Fluoride
Other atoms:
Mg (1);
Al (1);
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4xq0 (F: 3) - Structure of Fission Yeast Rna Polymerase II Ctd Phosphatase FCP1- R271A Bound to Beryllium Fluoride
Other atoms:
Mg (1);
-
4xry (F: 8) - Human Cytochrome P450 2D6 BACE1 Inhibitor 5 Complex
Other atoms:
Fe (4);
Zn (17);
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4xrz (F: 8) - Human Cytochrome P450 2D6 BACE1 Inhibitor 6 Complex
Other atoms:
Zn (12);
Fe (4);
Na (4);
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4xsx (F: 6) - Crystal Structure of Cbr 703 Bound to Escherichia Coli Rna Polymerase Holoenzyme
Other atoms:
Mg (2);
Zn (4);
-
4xsy (F: 6) - Crystal Structure of Cbr 9379 Bound to Escherichia Coli Rna Polymerase Holoenzyme
Other atoms:
Mg (2);
Zn (4);
Cl (4);
-
4xsz (F: 8) - Crystal Structure of Cbr 9393 Bound to Escherichia Coli Rna Polymerase Holoenzyme
Other atoms:
Mg (2);
Zn (4);
-
4xty (F: 2) - Mycobacterium Tuberculosis Biotin Ligase Complexed with Bisubstrate Inhibitor 63 with Fluorine in Place of 2'Oh
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4xtz (F: 2) - Mycobacterium Tuberculosis Biotin Ligase Complexed with Bisubstrate Inhibitor 69 That Has A Fluorine in Place of the Ribose 2'Oh
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4xug (F: 3) - Crystal Structure of Tryptophan Synthase From Salmonella Typhimurium in Complex with 2-({[4-(Trifluoromethoxy)Phenyl]Sulfonyl}Amino)Ethyl Dihydrogen Phosphate (F9F) Inhibitor in the Alpha Site and Ammonium Ion in the Metal Coordination Site.
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4xuh (F: 4) - Ppargamma Ligand Binding Domain in Complex with Sulindac Sulfide
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4xv1 (F: 2) - B-Raf Kinase V600E Oncogenic Mutant in Complex with PLX7904
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4xv2 (F: 6) - B-Raf Kinase V600E Oncogenic Mutant in Complex with Dabrafenib
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4xv3 (F: 1) - B-Raf Kinase V600E Oncogenic Mutant in Complex with PLX7922
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4xv9 (F: 5) - B-Raf Kinase Domain in Complex with PLX5568
Other atoms:
Cl (1);
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4xvd (F: 6) - 17BETA-HSD5 in Complex with 4-Nitro-2-({4-[3-(Trifluoromethyl) Phenyl]Piperazin-1-Yl}Methyl)Phenol
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4xxs (F: 2) - Crystal Structure of BACE1 with A Pyrazole-Substituted Tetrahydropyran Thioamidine
Other atoms:
I (2);
Page generated: Tue Feb 25 09:22:30 2025
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