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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).
  1. 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
  2. 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
  3. 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
  4. 4x7q (F: 4) - PIM2 Kinase in Complex with Compound 1S
  5. 4xdk (F: 24) - Crystal Structure of Human Two Pore Domain Potassium Ion Channel TREK2 (K2P10.1) in Complex with Norfluoxetine
    Other atoms: K (6);
  6. 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);
  7. 4xe0 (F: 1) - Idelalisib Bound to the P110 Subunit of PI3K Delta
  8. 4xe5 (F: 3) - Crystal Structure of the Na,K-Atpase From Bovine
    Other atoms: Mg (3);
  9. 4xew (F: 2) - Crystal Structure of 7,8-Diaminopelargonic Acid Synthase (Bioa) From Mycobacterium Tuberculosis, Complexed with A Hts Lead Compound
  10. 4xg3 (F: 2) - Crystal Structure of An Inhibitor-Bound Syk
  11. 4xg4 (F: 1) - Crystal Structure of An Inhibitor-Bound Syk
  12. 4xhk (F: 2) - PIM1 Kinase in Complex with Compound 1S
  13. 4xj0 (F: 2) - Crystal Structure of ERK2 in Complex with An Inhibitor 14K
    Other atoms: Cl (2);
  14. 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
  15. 4xjr (F: 2) - The Catalytic Mechanism of Human Parainfluenza Virus Type 3 Haemagglutinin-Neuraminidase Revealed
    Other atoms: Ca (2);
  16. 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);
  17. 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
  18. 4xkx (F: 2) - Crystal Structure of BACE1 in Complex with 2-Aminooxazoline 3- Azaxanthene Inhibitor 28
    Other atoms: I (4);
  19. 4xm6 (F: 1) - Anthrax Toxin Lethal Factor with Ligand-Induced Binding Pocket
    Other atoms: Zn (1);
  20. 4xm7 (F: 1) - Anthrax Toxin Lethal Factor with Ligand-Induced Binding Pocket
    Other atoms: Zn (1);
  21. 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
  22. 4xnv (F: 3) - The Human P2Y1 Receptor in Complex with Bptu
    Other atoms: Zn (1);
  23. 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);
  24. 4xpz (F: 3) - Structure of Fission Yeast Rna Polymerase II Ctd Phosphatase FCP1- R271A Bound to Aluminum Fluoride
    Other atoms: Mg (1); Al (1);
  25. 4xq0 (F: 3) - Structure of Fission Yeast Rna Polymerase II Ctd Phosphatase FCP1- R271A Bound to Beryllium Fluoride
    Other atoms: Mg (1);
  26. 4xry (F: 8) - Human Cytochrome P450 2D6 BACE1 Inhibitor 5 Complex
    Other atoms: Fe (4); Zn (17);
  27. 4xrz (F: 8) - Human Cytochrome P450 2D6 BACE1 Inhibitor 6 Complex
    Other atoms: Zn (12); Fe (4); Na (4);
  28. 4xsx (F: 6) - Crystal Structure of Cbr 703 Bound to Escherichia Coli Rna Polymerase Holoenzyme
    Other atoms: Mg (2); Zn (4);
  29. 4xsy (F: 6) - Crystal Structure of Cbr 9379 Bound to Escherichia Coli Rna Polymerase Holoenzyme
    Other atoms: Mg (2); Zn (4); Cl (4);
  30. 4xsz (F: 8) - Crystal Structure of Cbr 9393 Bound to Escherichia Coli Rna Polymerase Holoenzyme
    Other atoms: Mg (2); Zn (4);
  31. 4xty (F: 2) - Mycobacterium Tuberculosis Biotin Ligase Complexed with Bisubstrate Inhibitor 63 with Fluorine in Place of 2'Oh
  32. 4xtz (F: 2) - Mycobacterium Tuberculosis Biotin Ligase Complexed with Bisubstrate Inhibitor 69 That Has A Fluorine in Place of the Ribose 2'Oh
  33. 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.
  34. 4xuh (F: 4) - Ppargamma Ligand Binding Domain in Complex with Sulindac Sulfide
  35. 4xv1 (F: 2) - B-Raf Kinase V600E Oncogenic Mutant in Complex with PLX7904
  36. 4xv2 (F: 6) - B-Raf Kinase V600E Oncogenic Mutant in Complex with Dabrafenib
  37. 4xv3 (F: 1) - B-Raf Kinase V600E Oncogenic Mutant in Complex with PLX7922
  38. 4xv9 (F: 5) - B-Raf Kinase Domain in Complex with PLX5568
    Other atoms: Cl (1);
  39. 4xvd (F: 6) - 17BETA-HSD5 in Complex with 4-Nitro-2-({4-[3-(Trifluoromethyl) Phenyl]Piperazin-1-Yl}Methyl)Phenol
  40. 4xxs (F: 2) - Crystal Structure of BACE1 with A Pyrazole-Substituted Tetrahydropyran Thioamidine
    Other atoms: I (2);
Page generated: Fri May 13 23:04:43 2022

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