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Fluorine in PDB, part 119 (files: 4721-4760), PDB 5sxa-5tl8

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: 4721-4760 (PDB 5sxa-5tl8).
  1. 5sxa (F: 3) - Crystal Structure of PI3KALPHA in Complex with Fragment 10
  2. 5sxc (F: 1) - Crystal Structure of PI3KALPHA in Complex with Fragment 8
  3. 5sym (F: 6) - Cocrystal Structure of the Human Acyl Protein Thioesterase 1 with An Isoform-Selective Inhibitor, ML348
    Other atoms: Cl (6);
  4. 5sys (F: 6) - C-Src V281C Bound to N-[3-({6-[(1E)-2-Cyano-3-(Methylamino)-3-Oxoprop- 1-En-1-Yl]-7-(2-Methoxyethyl)-7H-Pyrrolo[2,3-D]Pyrimidin-5- Yl}Ethynyl)-4-Methylphenyl]-3-(Trifluoromethyl)Benzamide Inhibitor
  5. 5t18 (F: 2) - Crystal Structure of Bruton Agammabulinemia Tyrosine Kinase Complexed with Bms-986142 Aka (2S)-6-Fluoro-5-[3-(8-Fluoro-1-Methyl-2,4-Dioxo- 1,2,3,4-Tetrahydroquinazolin-3-Yl)-2-Methylphenyl]-2-(2- Hydroxypropan-2-Yl)-2,3,4,9-Tetrahydro-1H-Carbazole-8-Carboxamide
  6. 5t1a (F: 4) - Structure of Cc Chemokine Receptor 2 with Orthosteric and Allosteric Antagonists
    Other atoms: Cl (1); Zn (1);
  7. 5t1u (F: 5) - Aminomethyl-Derived Beta Secretase (BACE1) Inhibitors: Engaging GLY230 Without An Anilide Functionality
    Other atoms: I (3);
  8. 5t1w (F: 6) - Aminomethyl-Derived Beta Secretase (BACE1) Inhibitors: Engaging GLY230 Without An Anilide Functionality
    Other atoms: I (3); Cl (2); Na (2);
  9. 5t2p (F: 24) - Hepatitis B Virus Core Protein Y132A Mutant in Complex with Sulfamoylbenzamide (SBA_R01)
    Other atoms: Cl (5);
  10. 5t2w (F: 1) - Structure of Thymine Dna Glycosylase Bound to Substrate Analog 2'-F-5- Formyl-Dc
  11. 5t3q (F: 1) - Crystal Structure of the C-Met Kinase Domain in Complex with A Pyrazolone Inhibitor
  12. 5t45 (F: 4) - Chicken Smooth Muscle Myosin Motor Domain Co-Crystallized with the Specific Ck-571 Inhibitor, Mgadp.Befx Form
    Other atoms: Mg (1); Cl (1);
  13. 5t4k (F: 1) - Plp and Gaba Trigger Gabr-Mediated Transcription Regulation in Bacillus Subsidies Via External Aldimine Formation
  14. 5t6a (F: 1) - Crystal Structure of TGCDPK1 From Toxoplasma Gondii Complexed with 5GA
    Other atoms: Cl (1);
  15. 5t7f (F: 2) - PI3KDELTA in Complex with the Inhibitor Gs-643624
    Other atoms: Cl (2);
  16. 5t8i (F: 1) - PI3KDELTA in Complex with the Inhibitor Gs-9901
    Other atoms: Cl (1);
  17. 5t8j (F: 1) - Synthesis and Biological Evaluation of Novel Selective Androgen Receptor Modulators (Sarms). Part II: Optimization of 4-(Pyrrolidin- 1-Yl)Benzonitrile Derivatives
  18. 5t92 (F: 2) - Estrogen Receptor Alpha Ligand Binding Domain in Complex with (2E)-3- {4-[(1R)-2-(4-Fluorophenyl)-6-Hydroxy-1-Methy L-1,2,3,4- Tetrahydroisoquinolin-1-Yl]Phenyl}Prop-2-Enoic Acid
  19. 5ta8 (F: 2) - Crystal Structure of PLK1 in Complex with A Novel 5,6- Dihydroimidazolo[1,5-F]Pteridine Inhibitor
    Other atoms: Zn (1);
  20. 5tb9 (F: 1) - Precatalytic Ternary Complex of Human Dna Polymerase Beta in Closed Conformation with Gapped Dna Substrate Incoming (-)Ftc-Tp and MN2+.
    Other atoms: Mn (6); Na (4);
  21. 5tbb (F: 1) - Postcatalytic Ternary Complex of Human Dna Polymerase Beta with Gapped Dna Substrate, Incorporated (-)Ftc and Ppi.
    Other atoms: Mn (1); Na (4);
  22. 5tbe (F: 2) - Human P38ALPHA Map Kinase in Complex with Dibenzosuberone Compound 2
  23. 5tbm (F: 3) - Crystal Structure of PT2385 Bound to HIF2A-B*:Arnt-B* Complex
  24. 5tbo (F: 5) - Crystal Structure of Plasmodium Falciparum Dihydroorotate Dehydrogenase Bound with Inhibitor DSM421
  25. 5tbp (F: 6) - Crystal Structure of Rxr-Alpha Ligand Binding Domain Complexed with Synthetic Modulator K8003
  26. 5tci (F: 5) - Crystal Structure of Tryptophan Synthase From M. Tuberculosis - BRD4592-Bound Form
  27. 5tcj (F: 4) - Crystal Structure of Tryptophan Synthase From M. Tuberculosis - Aminoacrylate and BRD4592-Bound Form
    Other atoms: Cs (9);
  28. 5tco (F: 1) - Human P38 Map Kinase in Complex with Dibenzosuberone Compound 1
  29. 5td7 (F: 3) - Crystal Structure of Histone Deacetylase 10
    Other atoms: K (2); Zn (1);
  30. 5tdi (F: 4) - Crystal Structure of Cathepsin K with A Covalently-Linked Inhibitor at 1.4 Angstrom Resolution.
  31. 5te8 (F: 3) - Crystal Structure of the Midazolam-Bound Human CYP3A4
    Other atoms: Fe (3); Cl (3);
  32. 5tei (F: 1) - Structure of Human ALDH1A1 with Inhibitor CM039
    Other atoms: Yb (2); Cl (1);
  33. 5tft (F: 20) - Structure of Cytochrome P450 2D6 (CYP2D6) BACE1 Inhibitor Complex
    Other atoms: Fe (4); Zn (5);
  34. 5tfu (F: 20) - Structure of Cytochrome P450 2D6 (CYP2D6) BACE1 Inhibitor Complex
    Other atoms: Fe (4); Zn (5);
  35. 5tgy (F: 240) - uc(Nmr) Structure of Holo-PS1
    Other atoms: Zn (20);
  36. 5ti2 (F: 1) - Crystal Structure of the First Bromodomain of Human BRD4 in Complex with Inhibitor 7635936
  37. 5ti4 (F: 1) - Crystal Structure of the First Bromodomain of Human BRD4 in Complex with Inhibitor 8841871
    Other atoms: Cl (1);
  38. 5ti6 (F: 2) - Crystal Structure of the First Bromodomain of Human BRD4 in Complex with Inhibitor 8841881
  39. 5tkb (F: 16) - Crystal Structure of Human Phosphodiesterase 4D in Complex with A Tetrafluoranline Compound
    Other atoms: Mg (4); Zn (4);
  40. 5tl8 (F: 2) - Naegleria Fowleri CYP51-Posaconazole Complex
    Other atoms: Fe (1); Ca (2);
Page generated: Fri May 13 23:13:56 2022

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