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Fluorine in PDB, part 88 (files: 3481-3520), PDB 4zg9-4zzh

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: 3481-3520 (PDB 4zg9-4zzh).
  1. 4zg9 (F: 4) - Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
    Other atoms: Zn (4); Ca (2); Na (4);
  2. 4zga (F: 1) - Structural Basis For Inhibition of Human Autotaxin By Four Novel Compounds
    Other atoms: Ca (2); Zn (1);
  3. 4zgx (F: 10) - Structure of Aldosterone Synthase (CYP11B2) in Complex with (+)-(R)-N- (4-(4-Chloro-3-Fluorophenyl)-5,6,7,8-Tetrahydroisoquinolin-8-Yl) Propionamide
    Other atoms: Fe (12); Cl (10);
  4. 4zh2 (F: 6) - Crystal Structure of Escherichia Coli Rna Polymerase in Complex with CBR703
    Other atoms: Mg (2); Zn (4);
  5. 4zh3 (F: 8) - Crystal Structure of Escherichia Coli Rna Polymerase in Complex with CBRH16-Br
    Other atoms: Mg (2); Zn (4); Br (2);
  6. 4zh4 (F: 10) - Crystal Structure of Escherichia Coli Rna Polymerase in Complex with CBRP18
    Other atoms: Mg (2); Zn (4);
  7. 4zha (F: 1) - Factor Xa Complex with GTC000102
    Other atoms: Mg (1); Ca (1); Cl (1);
  8. 4zjc (F: 1) - Structures of the Human OX1 Orexin Receptor Bound to Selective and Dual Antagonists
  9. 4zji (F: 4) - PAK1 in Complex with 2-Chloro-5-Ethyl-8-Fluoro-11-(4-Methylpiperazin- 1-Yl)-Dibenzodiazepine
    Other atoms: Mg (2); Cl (4);
  10. 4zjj (F: 4) - PAK1 in Complex with (S)-N-(Tert-Butyl)-3-((2-Chloro-5-Ethyl-8-Fluoro- Dibenzodiazepin-11-Yl)Amino)Pyrrolidine-1-Carboxamide
    Other atoms: Mg (2); Cl (4);
  11. 4zjr (F: 16) - Rorgamma in Complex with Inverse Agonist 48
    Other atoms: Cl (8);
  12. 4zjw (F: 1) - Rorgamma in Complex with Inverse Agonist 16
    Other atoms: Cl (2);
  13. 4zk5 (F: 1) - MAP4K4 in Complex with Inhibitor Gne-495
    Other atoms: Mg (1);
  14. 4zl1 (F: 1) - Crystal Structure of Human Dihydroorotate Dehydrogenase (Dhodh) with 18X at 1.86 A Resolution
  15. 4zlo (F: 2) - Serine/Threonine-Protein Kinase PAK1 Complexed with A Dibenzodiazepine: Identification of An Allosteric Site on PAK1
  16. 4zmg (F: 2) - Crystal Structure of Human Dihydroorotate Dehydrogenase (Dhodh) with DH03A338
  17. 4zmr (F: 6) - Structural Characterization of the Full-Length Response Regulator SPR1814 in Complex with A Phosphate Analogue Reveals A Novel Conformational Plasticity of the Linker Region
    Other atoms: Mg (2);
  18. 4zms (F: 6) - Structure of the Full-Length Response Regulator SPR1814 in Complex with A Phosphate Analogue and B3C
    Other atoms: Mg (2); Br (3);
  19. 4znh (F: 3) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with A 2-Fluoro-Substituted Obhs Derivative
  20. 4znl (F: 9) - Thermus Phage P74-26 Large Terminase Atpase Domain Bound to Adp Beryllium Fluoride
    Other atoms: Mg (3);
  21. 4zns (F: 2) - Crystal Structure of the Er-Alpha Ligand-Binding Domain (Y537S) in Complex with A 3-Fluoro-Substituted Obhs Derivative
  22. 4zom (F: 4) - Rorgamma in Complex with Inverse Agonist 4J.
    Other atoms: Cl (4);
  23. 4zpe (F: 1) - BACE1 in Complex with 4-(Cyclohexylamino)-1-(3-Fluorophenyl)-8-(3- Isopropoxybenzyl)-1,3,8-Triazaspiro[4.5]Dec-3-En-2-One
  24. 4zpf (F: 1) - BACE1 in Complex with 8-(3-((1-Aminopropan-2-Yl)Oxy)Benzyl)-4- (Cyclohexylamino)-1-(3-Fluorophenyl)-1,3,8-Triazaspiro[4.5]Dec-3-En- 2-One
  25. 4zpg (F: 1) - BACE1 in Complex with 8-Benzyl-4-(Cyclohexylamino)-1-(3-Fluorophenyl)- 7-Methyl-1,3,8-Triazaspiro[4.5]Dec-3-En-2-One
  26. 4zqc (F: 9) - Tryptophan Synthase From Salmonella Typhimurium in Complex with Two Molecules of N-(4'-Trifluoromethoxybenzoyl)-2-Amino-1-Ethylphosphate (F6F) Inhibitor in the Alpha-Site and A Single F6F Molecule in the Beta-Site at 1.54 Angstrom Resolution.
    Other atoms: Na (1);
  27. 4zqd (F: 1) - Crystal Structure of the Heterodimeric Hif-2A:Arnt Complex with the Benzoxadiazole Antagonist 0X3
    Other atoms: Cl (1);
  28. 4zt3 (F: 1) - Trypanosoma Brucei Methionyl-Trna Synthetase in Complex with Inhibitor N-(3,5-Dichlorobenzyl)-N'-(5-Fluoro-1H-Imidazo[4,5-B]Pyridin-2-Yl) Propane-1,3-Diamine (Chem 1614)
    Other atoms: As (2); Cl (2);
  29. 4zt4 (F: 2) - Trypanosoma Brucei Methionyl-Trna Synthetase in Complex with Inhibitorn-(3,5-Dichlorobenzyl)-2,2-Difluoro-N'-(1H-Imidazo[4,5- B]Pyridin-2-Yl)Propane-1,3-Diamine (Chem 1708)
    Other atoms: As (2); Cl (2);
  30. 4zt6 (F: 1) - Trypanosoma Brucei Methionyl-Trna Synthetase in Complex with Inhibitor N-[(4R)-6,8-Dichloro-3,4-Dihydro-2H-Chromen-4-Yl]-N'-(5-Fluoro-1H- Imidazo[4,5-B]Pyridin-2-Yl)Propane-1,3-Diamine (Chem 1709)
    Other atoms: As (2); Cl (2);
  31. 4zt7 (F: 1) - Trypanosoma Brucei Methionyl-Trna Synthetase in Complex with Inhibitor N-[(4R)-6,8-Dichloro-1,2,3,4-Tetrahydroquinolin-4-Yl]-N'-(5-Fluoro- 3H-Imidazo[4,5-B]Pyridin-2-Yl)Propane-1,3-Diamine (Chem 1717)
    Other atoms: As (2); Cl (2);
  32. 4ztf (F: 1) - Crystal Structure of the Prototype Foamy Virus Intasome with A 2- Pyridinone Aminal Inhibitor
    Other atoms: Mg (3); Zn (1); Cl (1);
  33. 4zth (F: 1) - Structure of Human P38AMAPK-Arylpyridazinylpyridine Fragment Complex Used in Inhibitor Discovery
    Other atoms: Cl (1);
  34. 4ztj (F: 1) - Crystal Structure of the Prototype Foamy Virus Intasome with A 2- Pyridinone Aminal Inhibitor
    Other atoms: Mg (3); Zn (1); Cl (1);
  35. 4ztv (F: 6) - Non-Anthranilate-Like Inhibitor (Tamu-A7) Complexed with Anthranilate Phosphoribosyltransferase (Trpd) From Mycobacterium Tuberculosis in Absence of Prpp
  36. 4zum (F: 6) - Crystal Structure of Acetylpolyamine Amidohydrolase From Mycoplana Ramosa in Complex with A Trifluoromethylketone Inhibitor
    Other atoms: K (2); Zn (2); Na (2);
  37. 4zw7 (F: 3) - X-Ray Crystal Structure of Pfa-M1 in Complex with Hydroxamic Acid- Based Inhibitor 9M
    Other atoms: Mg (3); Zn (1);
  38. 4zx4 (F: 3) - X-Ray Crystal Structure of Pfa-M1 in Complex with Hydroxamic Acid- Based Inhibitor 10O
    Other atoms: Mg (1); Zn (1);
  39. 4zy2 (F: 36) - X-Ray Crystal Structure of Pfa-M17 in Complex with Hydroxamic Acid- Based Inhibitor 10O
    Other atoms: Zn (24);
  40. 4zzh (F: 3) - SIRT1/Activator Complex
    Other atoms: Zn (1);
Page generated: Tue Dec 1 09:23:25 2020

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