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Fluorine in PDB, part 58 (files: 2281-2320), PDB 4b00-4bjk

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: 2281-2320 (PDB 4b00-4bjk).
  1. 4b00 (F: 1) - Design and Synthesis of BACE1 Inhibitors with in Vivo Brain Reduction of Beta-Amyloid Peptides (Compound (R)-41)
  2. 4b05 (F: 3) - Preclinical Characterization of AZD3839, A Novel Clinical Candidate BACE1 Inhibitor For the Treatment of Alzheimer Disease
    Other atoms: Na (1);
  3. 4b0p (F: 5) - Crystal Structure of Soman-Aged Human Butyrylcholinesterase in Complex with Methyl 2-(Pentafluorobenzyloxyimino) Pyridinium
    Other atoms: K (1); Ca (4); Cl (4); Na (2);
  4. 4b2j (F: 1) - Complexes of Dodecin with Flavin and Flavin-Like Ligands
    Other atoms: Mg (2); Cl (1); Na (1);
  5. 4b3o (F: 3) - Structures of Hiv-1 Rt and Rna-Dna Complex Reveal A Unique Rt Conformation and Substrate Interface
    Other atoms: Ca (2); Cl (1);
  6. 4b4m (F: 4) - Pseudomonas Aeruginosa Rmla in Complex with Allosteric Inhibitor
    Other atoms: Cl (4);
  7. 4b6p (F: 5) - Structure of Mycobacterium Tuberculosis Type II Dehydroquinase Inhibited By (2S)-2-Perfluorobenzyl-3- Dehydroquinic Acid
  8. 4b6s (F: 15) - Structure of Mycobacterium Tuberculosis Type II Dehydroquinase Inhibited By (2S)-2-Perfluorobenzyl-3-Dehydroquinic Acid
  9. 4b71 (F: 2) - Discovery of An Allosteric Mechanism For the Regulation of Hcv NS3 Protein Function
    Other atoms: Cl (2);
  10. 4b73 (F: 2) - Discovery of An Allosteric Mechanism For the Regulation of Hcv NS3 Protein Function
    Other atoms: Cl (2);
  11. 4b74 (F: 2) - Discovery of An Allosteric Mechanism For the Regulation of Hcv NS3 Protein Function
    Other atoms: Cl (2);
  12. 4b75 (F: 2) - Discovery of An Allosteric Mechanism For the Regulation of Hcv NS3 Protein Function
    Other atoms: Cl (2);
  13. 4b76 (F: 4) - Discovery of An Allosteric Mechanism For the Regulation of Hcv NS3 Protein Function
  14. 4b80 (F: 2) - Mus Musculus Acetylcholinesterase in Complex with N-(2- Diethylamino-Ethyl)-1-(4-Fluoro-Phenyl)-Methanesulfonamide
  15. 4b82 (F: 3) - Mus Musculus Acetylcholinesterase in Complex with N-(2-Diethylamino- Ethyl)-2-Fluoranyl-Benzenesulfonamide
  16. 4b84 (F: 9) - Mus Musculus Acetylcholinesterase in Complex with N-(2-Diethylamino- Ethyl)-3-Trifluoromethyl-Benzenesulfonamide
  17. 4b9e (F: 3) - Structure of A Putative Epoxide Hydrolase From Pseudomonas Aeruginosa, with Bound Mfa.
  18. 4ba0 (F: 1) - Crystal Structure of AGD31B, Alpha-Transglucosylase, Complexed with 5F-Alpha-Glcf
  19. 4bau (F: 6) - Structure of A Putative Epoxide Hydrolase T131D Mutant From Pseudomonas Aeruginosa, with Bound Mfa
    Other atoms: Cl (1);
  20. 4bb0 (F: 5) - Structure of A Putative Epoxide Hydrolase Q244E Mutant From Pseudomonas Aeruginosa, with Bound Mfa.
  21. 4bbj (F: 3) - Atpase Crystal Structure
    Other atoms: Mg (1);
  22. 4bc5 (F: 3) - Crystal Structure of Human D-Xylulokinase in Complex with Inhibitor 5-Deoxy-5-Fluoro-D-Xylulose
  23. 4bcd (F: 1) - Prolyl Oligopeptidase From Porcine Brain with A Non- Covalently Bound P2-Substituted N-Acyl-Prolylpyrrolidine Inhibitor
  24. 4bdy (F: 1) - Pfv Intasome with Inhibitor Xz-89
    Other atoms: Mg (2); Zn (1); Cl (1);
  25. 4bdz (F: 1) - Pfv Intasome with Inhibitor Xz-90
    Other atoms: Mg (2); Zn (1); Cl (1);
  26. 4be0 (F: 1) - Pfv Intasome with Inhibitor Xz-115
    Other atoms: Mg (2); Zn (1); Cl (1);
  27. 4be1 (F: 1) - Pfv Intasome with Inhibitor Xz-116
    Other atoms: Mg (3); Zn (1); Cl (1);
  28. 4be2 (F: 1) - Pfv Intasome with Inhibitor Xz-259
    Other atoms: Mg (3); Zn (1); Cl (1);
  29. 4bev (F: 3) - Atpase Crystal Structure with Bound Phosphate Analogue
    Other atoms: Mg (2);
  30. 4bew (F: 6) - Serca Bound to Phosphate Analogue
    Other atoms: Mg (4); K (2); Mn (3);
  31. 4bfd (F: 1) - Crystal Structure of Bace-1 in Complex with Chemical Ligand
    Other atoms: Cl (1); Na (2);
  32. 4bfs (F: 4) - Crystal Structure of Mycobacterium Tuberculosis Pank in Complex with A Triazole Inhibitory Compound (1A)
  33. 4bft (F: 2) - Crystal Structure of Mycobacterium Tuberculosis Pank in Complex with A Triazole Inhibitory Compound (1B) and Phosphate
    Other atoms: Cl (2);
  34. 4bfu (F: 8) - Crystal Structure of Mycobacterium Tuberculosis Pank in Complex with A Triazole Inhibitory Compound (1C) and Phosphate
  35. 4bfv (F: 6) - Crystal Structure of Mycobacterium Tuberculosis Pank in Complex with A Triazole Inhibitory Compound (1D) and Phosphate
  36. 4bfw (F: 10) - Crystal Structure of Mycobacterium Tuberculosis Pank in Complex with A Triazole Inhibitory Compound (1E) and Phosphate
  37. 4bfx (F: 6) - Crystal Structure of Mycobacterium Tuberculosis Pank in Complex with A Triazole Inhibitory Compound (1F) and Phosphate
  38. 4bgm (F: 1) - Three Dimensional Structure of Human Gamma-Butyrobetaine Hydroxylase in Complex with 3-Carboxy-N-(2-Fluoroethyl)-N, N-Dimethylpropan-1-Aminium Chloride
    Other atoms: Zn (2);
  39. 4bjc (F: 1) - Crystal Structure of Human Tankyrase 2 in Complex with Rucaparib
    Other atoms: Zn (1);
  40. 4bjk (F: 2) - CYP51 of Trypanosoma Brucei Bound to (S)-N-(3-(1H-Indol-3- Yl)-1-Oxo-1-(Pyridin-4-Ylamino)Propan-2-Yl)-3,3'-Difluoro-( 1,1'-Biphenyl)-4-Carboxamide
    Other atoms: Fe (4);
Page generated: Fri May 13 22:57:23 2022

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