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Fluorine in PDB, part 130 (files: 5161-5200), PDB 6bxy-6cpw

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: 5161-5200 (PDB 6bxy-6cpw).
  1. 6bxy (F: 3) - Menin in Complex with Mi-1481
  2. 6by8 (F: 3) - Menin in Complex with Mi-1482
  3. 6byz (F: 6) - Structure of Cysteine-Free Human Insulin-Degrading Enzyme in Complex with Substrate-Selective Macrocyclic Inhibitor 37
  4. 6bz2 (F: 4) - Crystal Structure of Wild-Type Hiv-1 Protease with A Novel Hiv-1 Inhibitor Grl-14213A of 6-5-5-Ring Fused Crown-Like Tetrahydropyranofuran As the P2-Ligand, A Cyclopropylaminobenzothiazole As the P2'-Ligand and 3,5- Difluorophenylmethyl As the P1-Ligand
    Other atoms: Cl (2); Na (1);
  5. 6c0t (F: 1) - Crystal Structure of Cgmp-Dependent Protein Kinase Ialpha (Pkg Ialpha) Catalytic Domain Bound with N46
  6. 6c0u (F: 1) - Crystal Structure of Camp-Dependent Protein Kinase Calpha Subunit Bound with N46
  7. 6c1r (F: 4) - Crystal Structure of Human C5A Receptor in Complex with An Orthosteric Antagonist PMX53 and An Allosteric Antagonist Avacopan
    Other atoms: Na (1);
  8. 6c2i (F: 1) - Structure of Bace-1 (Beta-Secretase) in Complex with : N-(3-((1R,5S, 6R)-3-Amino-5-Methyl-2-Oxa-4-Azabicyclo[4.1.0]Hept-3-En-5-Yl)-4- Fluorophenyl)-5-Methoxypyrazine-2-Carboxamide
    Other atoms: I (3);
  9. 6c2n (F: 1) - Crystal Structure of Hcv NS3/4A Double Mutant Variant Y56H/D168A in Complex with Danoprevir
    Other atoms: Zn (1);
  10. 6c2o (F: 2) - Crystal Structure of Hcv NS3/4A Protease Variant Y56H in Complex with Danoprevir
    Other atoms: Zn (1);
  11. 6c2r (F: 2) - Aurora A Ligand Complex
    Other atoms: Cl (1);
  12. 6c2t (F: 1) - Aurora A Ligand Complex
    Other atoms: Cl (1);
  13. 6c2y (F: 1) - Human GRK2 in Complex with Gbetagamma Subunits and CCG257142
  14. 6c3f (F: 3) - Amyloid Forming Peptide Iykvei From Transthyretin
  15. 6c57 (F: 1) - Crystal Structure of Mutant Human Geranylgeranyl Pyrophosphate Synthase (Y246D) in Complex with Bisphosphonate Inhibitor FV0109
  16. 6c73 (F: 3) - Tryptophan Synthase Q114A Mutant (Internal Aldimine State) in Complex with N-(4'-Trifluoromethoxybenzenesulfonyl)-2-Amino-1-Ethylphosphate (F9F) with Cesium Ion Bound in the Metal Coordination Site
    Other atoms: Cs (5); Cl (1);
  17. 6c8p (F: 1) - Crystal Structure of Mycobacterium Tuberculosis Malate Synthase in Complex with 2-F-Phenyldiketoacid
    Other atoms: Mg (3);
  18. 6c98 (F: 2) - Crystal Structure of Fcrn Bound to Ucb-84
  19. 6c99 (F: 4) - Crystal Structure of Fcrn Bound to Ucb-303
  20. 6cad (F: 6) - Crystal Structure of Raf Kinase Domain Bound to the Inhibitor 2A
  21. 6cbh (F: 1) - Macrophage Migration Inhibitory Factor in Complex with A Pyrazole Inhibitor (8M)
  22. 6ccs (F: 6) - Crystal Structure of E.Coli Phosphopantetheine Adenylyltransferase (Ppat/Coad) in Complex with 2-(Trifluoromethyl)-1H-Benzo[D]Imidazol- 4-Ol
  23. 6ccy (F: 4) - Crystal Structure of AKT1 in Complex with A Selective Inhibitor
  24. 6cdj (F: 4) - Hiv-1 Wild Type Protease with Grl-03314A, 6-5-5-Ring Fused Umbrella- Like Tetrahydropyranofuran As the P2-Ligand, A Cyclopropylaminobenzothiazole As the P2'-Ligand and 3,5- Difluorophenylmethyl As the P1-Ligand
    Other atoms: Cl (3); Na (1);
  25. 6cdl (F: 4) - Hiv-1 Wild Type Protease with Grl-03214A, 6-5-5-Ring Fused Umbrella- Like Tetrahydropyranofuran As the P2-Ligand, A Cyclopropylaminobenzothiazole As the P2'-Ligand and 3,5- Difluorophenylmethyl As the P1-Ligand
    Other atoms: Cl (2); Na (1);
  26. 6cdx (F: 1) - High-Resolution Crystal Structure of Fluoropropylated Cystine Knot, Binding to Alpha-5 Beta-6 Integrin
  27. 6cfd (F: 22) - ADEP4 Bound to E. Faecium Clpp
  28. 6cfm (F: 6) - Crystal Structure of the Human Vaccinia-Related Kinase Bound to A Propynyl-Pteridinone Inhibitor
    Other atoms: Cl (7);
  29. 6cfp (F: 1) - Crystal Structure of Polymerase Acid Protein (Pa) From Influenza A Virus, Wilson-Smith/1933 (H1N1) Bound to Fragment Hit Bsi-70565 1-{1- [4-Fluorophenyl)Methyl]-2-Methyl-1H-Imidazol-4-Yl}Ethan-1-One
  30. 6cg1 (F: 4) - Crystal Structure of KDM4A with Compound 14
    Other atoms: Ni (4); Zn (4);
  31. 6cjf (F: 2) - Human Dihydroorotate Dehydrogenase Bound to 4-Quinoline Carboxylic Acid Inhibitor 43
    Other atoms: Cl (4);
  32. 6cjr (F: 3) - Candida Albicans HSP90 Nucleotide Binding Domain in Complex with Snx- 2112
  33. 6cl0 (F: 5) - Human Caspase-3 in Complex with Ac-ATS009-Ke
  34. 6cl2 (F: 10) - Caspase-7 in Complex with Ac-ATS009-Ke
  35. 6cm4 (F: 1) - Structure of the D2 Dopamine Receptor Bound to the Atypical Antipsychotic Drug Risperidone
  36. 6cmm (F: 4) - Crystal Structure of the Human Vaccinia-Related Kinase Bound to A N,N- Dipropynyl-Dihydropteridine Inhibitor
  37. 6cnh (F: 1) - Human PRPF4B in Complex with Rebastinib
  38. 6cnx (F: 8) - Crystal Structure of the Human Vaccinia-Related Kinase 1 (VRK1) Bound to An N-Propynyl-N-Isopentyl-Dihydropteridin Inhibitor
  39. 6cox (F: 6) - Cyclooxygenase-2 (Prostaglandin Synthase-2) Complexed with A Selective Inhibitor, Sc-558 in I222 Space Group
    Other atoms: Br (2); Fe (2);
  40. 6cpw (F: 1) - Discovery of 3(S)-Thiomethyl Pyrrolidine Erk Inhibitors For Oncology
Page generated: Tue Dec 1 09:26:48 2020

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