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Fluorine in PDB, part 120 (files: 4761-4800), PDB 5tlf-5u1y

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: 4761-4800 (PDB 5tlf-5u1y).
  1. 5tlf (F: 6) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with the Constrained Way Derivative, 4-(2-(3-Methylbut-2-En- 1-Yl)-7-(Trifluoromethyl)-2H-Indazol-3-Yl)Benzene-1,3-Diol
  2. 5tlp (F: 1) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with the Obhs-Bsc Analog, 3-Fluorophenyl (1R,2R,4S)-5-(4- Hydroxyphenyl)-6-(4-(2-(Piperidin-1-Yl)Ethoxy)Phenyl)-7- Oxabicyclo[2.2.1]Hept-5-Ene-2-Sulfonate and 3-Methyl-6-Phenyl-3H- Imidazo[4,5-B]Pyridin-2-Amine
  3. 5tlv (F: 4) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with 4,4'-(Thiophene-2,3-Diyl)Bis(3-Fluorophenol)
  4. 5tly (F: 4) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with 3,4-Bis(2-Fluoro-4-Hydroxyphenyl)Thiophene 1,1-Dioxide
  5. 5tm1 (F: 4) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with 2,5-Bis(2-Fluoro-4-Hydroxyphenyl)Thiophene 1-Oxide
  6. 5tmd (F: 1) - Crystal Structure of OS79 From O. Sativa in Complex with U2F and Trichothecene.
  7. 5tn7 (F: 3) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with (E)-3'-Fluoro-4'-Hydroxy-3-((Hydroxyiminio)Methyl)-[1, 1'-Biphenyl]-4-Olate
  8. 5to8 (F: 3) - Selectivity Switch Between Fak and PYK2: Macrocyclization of Fak Inhibitors Improves PYK2 Potency
  9. 5tob (F: 3) - Selectivity Switch Between Fak and PYK2: Macrocyclization of Fak Inhibitors Improves PYK2 Potency
  10. 5tol (F: 1) - Crystal Structure of Beta-Site App-Cleaving Enzyme 1 Complexed with N- (3-((4AS,7AS)-2-Amino-4,4A,5,6-Tetrahydro-7AH-Furo[2,3-D][1, 3]Thiazin-7A-Yl)-4-Fluorophenyl)-5-Bromo-2-Pyridinecarboxamide
    Other atoms: Br (1);
  11. 5tp9 (F: 3) - Structure of the Human GLUN1/GLUN2A Lbd in Complex with Compound 2 (GNE9178)
    Other atoms: Cl (1); Ca (1);
  12. 5tpa (F: 3) - Structure of the Human GLUN1/GLUN2A Lbd in Complex with Compound 9 (GNE3500)
    Other atoms: Cl (1);
  13. 5tpg (F: 3) - Optimization of Spirocyclic Proline Tryptophanhydroxylase-1 Inhibitors
    Other atoms: Fe (1); Cl (1);
  14. 5tq8 (F: 1) - Design and Synthesis of A Pan-Jak Kinase Inhibitor Clinical Candidate (Pf-06263276) Suitable For Inhaled and Topical Delivery For the Treatment of Inflammatory Diseases of the Lungs and Skin
  15. 5tqg (F: 3) - Factor Viia in Complex with the Inhibitor (5R,11R)-11-[(1-Amino-4- Fluoroisoquinolin-6-Yl)Amino]-16-(Cyclopropylsulfonyl)-7-(2,2- Difluoroethoxy)-5,13-Dimethyl-2,13-Diazatricyclo[13.3.1.1~6, 10~]Icosa-1(19),6(20),7,9,15,17-Hexaene-3,12-Dione
    Other atoms: Ca (1);
  16. 5tqh (F: 4) - IDH1 R132H Mutant in Complex with IDH889
  17. 5tr4 (F: 6) - Structure of Ubiquitin Activating Enzyme (UBA1) in Complex with Ubiquitin and Tak-243
  18. 5tr6 (F: 1) - Discovery of Tak-659, An Orally Available Investigational Inhibitor of Spleen Tyrosine Kinase (Syk)
  19. 5trf (F: 5) - MDM2 in Complex with SAR405838
    Other atoms: Cl (10);
  20. 5trg (F: 14) - Structure of Mycobacterium Tuberculosis Proteasome in Complex with N, C-Capped Dipeptide Dplg-2
  21. 5tth (F: 6) - Heterodimeric Spycatcher/Spytag-Fused Zebrafish TRAP1 in Atp/Adp- Hybrid State
    Other atoms: Mg (2);
  22. 5tto (F: 4) - X-Ray Crystal Structure of Ppargamma in Complex with SR1643
    Other atoms: Br (2); Cl (4);
  23. 5tvj (F: 1) - Crystal Structure of Acetyltransferase Eis From Mycobacterium Tuberculosis in Complex with Coa and Inhibitor 2K*: 1-(4- Fluorophenyl)-2-[2-(4-Methylphenyl)-2-Oxoethyl]Pyrrolo[1,2-A]Pyrazin- 2-Ium
    Other atoms: Cl (1);
  24. 5tw3 (F: 2) - Crystal Structure of Hiv-1 Reverse Transcriptase in Complex with 5-(2- (2-(2,4-Dioxo-3,4-Dihydropyrimidin-1(2H)-Yl)Ethoxy)-4-Fluorophenoxy)- 7-Fluoro-2-Naphthonitrile (JLJ636), A Non-Nucleoside Inhibitor
    Other atoms: Mg (1);
  25. 5twm (F: 1) - Crystal Structure of the Hepatitis C Virus Genotype 2A Strain JFH1 L30S NS5B Rna-Dependent Rna Polymerase in Complex with 5-[3-(Tert- Butylcarbamoyl)Phenyl]-6-(Ethylamino)-2-(4-Fluorophenyl)-N- Methylfuro[2,3-B]Pyridine-3-Carboxamide
  26. 5twn (F: 1) - Crystal Structure of the Hepatitis C Virus NS5B Rna- Dependent Rna Polymerase in Complex with 5-[3-(Tert-Butylcarbamoyl)Phenyl]-6- (Ethylamino)-2-(4-Fluorophenyl)-N-Methylfuro[2,3-B]Pyridine-3- Carboxamide
  27. 5two (F: 1) - Peroxisome Proliferator-Activated Receptor Gamma Ligand Binding Domain in Complex with A Novel Selectively Ppar Gamma-Modulating Ligand Vsp- 51
    Other atoms: Cl (1);
  28. 5tyk (F: 1) - Alpha-Esterase-7 in Complex with 3-Chloro-4-[(2-Fluorophenyl) Methoxy]Phenylborinic Acid
    Other atoms: Cl (1);
  29. 5tys (F: 4) - X-Ray Crystal Structure of Wild Type Hiv-1 Protease in Complex with Grl-142
  30. 5tz1 (F: 14) - Crystal Structure of Sterol 14-Alpha Demethylase (CYP51) From Candida Albicans in Complex with the Tetrazole-Based Antifungal Drug Candidate VT1161 (VT1)
    Other atoms: Fe (2);
  31. 5tzc (F: 12) - Crystal Structure of Human PDE2A in Complex with (5S)-1-[(3-Bromo-4- Fluorophenyl)Carbonyl]-3,3-Difluoro-5-{5-Methyl-[1,2,4]Triazolo[1,5- A]Pyrimidin-7-Yl}Piperidine
    Other atoms: Mg (4); Zn (4); Br (4);
  32. 5tzh (F: 12) - Crystal Structure of Human Phosphodiesterase 2A in Complex with 3,3- Difluoro-1-[(4-Fluorophenyl)Carbonyl]-5-{5-Methyl-[1,2,4]Triazolo[1, 5-A]Pyrimidin-7-Yl}Piperidine
    Other atoms: Mg (4); Zn (4);
  33. 5tzw (F: 20) - Crystal Structure of Human Phosphodiesterase 2A in Complex with 1-[(3, 4-Difluorophenyl)Carbonyl]-3,3-Difluoro-5-{5-Methyl-[1,2, 4]Triazolo[1,5-A]Pyrimidin-7-Yl}Piperidine
    Other atoms: Mg (4); Zn (4);
  34. 5tzx (F: 12) - Crystal Structure of Human Phosphodiesterase 2A in Complex with 1-[(3- Chloro-4-Fluorophenyl)Carbonyl]-3,3-Difluoro-5-{5-Methyl-[1,2, 4]Triazolo[1,5-A]Pyrimidin-7-Yl}Piperidine
    Other atoms: Mg (4); Zn (4); Cl (4);
  35. 5tzy (F: 4) - GPR40 in Complex with Agopam AP8 and Partial Agonist Mk-8666
  36. 5tzz (F: 12) - Crystal Structure of Human Phosphodiesterase 2A in Complex with 1-[(3- Bromo-4-Fluorophenyl)Carbonyl]-3,3-Difluoro-5-{5-Methyl-[1,2, 4]Triazolo[1,5-A]Pyrimidin-7-Yl}Piperidine
    Other atoms: Mg (4); Zn (4); Br (4);
  37. 5u00 (F: 12) - Crystal Structure of Human Phosphodiesterase 2A in Complex with 3,3- Difluoro-1-[(4-Fluoro-3-Iodophenyl)Carbonyl]-5-{5-Methyl-[1,2, 4]Triazolo[1,5-A]Pyrimidin-7-Yl}Piperidine
    Other atoms: Mg (4); Zn (4); I (4);
  38. 5u09 (F: 3) - High-Resolution Crystal Structure of the Human CB1 Cannabinoid Receptor
    Other atoms: Cl (1);
  39. 5u12 (F: 2) - E. Coli Dihydropteroate Synthase Complexed with An 8-Mercaptoguanine Derivative: 2-Azanyl-8-[(2-Fluorophenyl)Methylsulfanyl]-1,9- Dihydropurin-6-One
  40. 5u1y (F: 2) - Crystal Structure of the Atp-Gated P2X7 Ion Channel Bound to Allosteric Antagonist GW791343
Page generated: Fri May 13 23:14:12 2022

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