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Fluorine in PDB, part 70 (files: 2761-2800), PDB 4jq2-4kbi

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: 2761-2800 (PDB 4jq2-4kbi).
  1. 4jq2 (F: 1) - AKR1C2 Complex with Sulindac
  2. 4jqg (F: 2) - Crystal Structure of An Inactive Mutant of Mmp-9 Catalytic Domain in Complex with A Fluorogenic Synthetic Peptidic Substrate with A Fluorine Atom.
    Other atoms: Sr (3); Zn (4); Ca (3); Na (3);
  3. 4jsc (F: 4) - The 2.5A Crystal Structure of Humanized Xenopus MDM2 with RO5316533 - A Pyrrolidine MDM2 Inhibitor
    Other atoms: Cl (4);
  4. 4jsi (F: 2) - Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-((3-(((3-Fluorophenethyl)Amino)Methyl)Phenoxy)Methyl)-4- Methylpyridin-2-Amine
    Other atoms: Fe (2); Zn (1);
  5. 4jsj (F: 2) - Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with 6-(((5-(((3-Fluorophenethyl)Amino)Methyl)Pyridin-3-Yl)Oxy) Methyl)-4-Methylpyridin-2-Amine
    Other atoms: Fe (2); Zn (1);
  6. 4jsm (F: 2) - Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with 6-(((5-(((3-Fluorophenethyl)Amino)Methyl)Pyridin-3-Yl) Oxy)Methyl)-4-Methylpyridin-2-Amine
    Other atoms: As (2); Fe (2); Zn (1);
  7. 4jsv (F: 6) - Structure of Mtordeltan-MLST8-Adp-MGF3-MG2 Complex
    Other atoms: Mg (6);
  8. 4jsx (F: 6) - Structure of Mtordeltan-MLST8-TORIN2 Complex
  9. 4jtq (F: 2) - AKR1C2 Complex with Flurbiprofen
  10. 4jtw (F: 12) - Crystal Structure of Hcv NS5B Polymerase in Complex with Coupound 1
    Other atoms: Mg (4);
  11. 4jty (F: 12) - Crystal Structure of Hcv NS5B Polymerase with Compound 2
    Other atoms: Mg (2);
  12. 4jtz (F: 12) - Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 4
    Other atoms: Mg (4);
  13. 4ju1 (F: 12) - Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 6
    Other atoms: Mg (4);
  14. 4ju2 (F: 12) - Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 12
    Other atoms: Mg (4);
  15. 4ju4 (F: 2) - Crystal Structure of Hcv NS5B Polymerase in Complex with Compound 22
    Other atoms: Br (2); Mg (2);
  16. 4juo (F: 1) - A Low-Resolution Three-Gate Structure of Topoisomerase IV From Streptococcus Pneumoniae in Space Group H32
    Other atoms: Mg (2);
  17. 4jve (F: 1) - Co-Crystal Structure of MDM2 with Inhibitor (2R,3E)-2-[(2S,3R,6S)-2,3- Bis(4-Chlorophenyl)-6-(4-Fluorobenzyl)-5-Oxomorpholin-4-Yl]Pent-3- Enoic Acid
    Other atoms: Cl (2);
  18. 4jvr (F: 3) - Co-Crystal Structure of MDM2 with Inhibitor (2'S,3R,4'S,5'R)-N-(2- Aminoethyl)-6-Chloro-4'-(3-Chloro-2-Fluorophenyl)-2'-(2,2- Dimethylpropyl)-2-Oxo-1,2-Dihydrospiro[Indole-3,3'-Pyrrolidine]-5'- Carboxamide
    Other atoms: Cl (6);
  19. 4jvs (F: 3) - Crystal Structure of Lepb Gap Domain From Legionella Drancourtii in Complex with RAB1-Gdp and ALF3
    Other atoms: Mg (1); Al (1);
  20. 4jx7 (F: 3) - Crystal Structure of PIM1 Kinase in Complex with Inhibitor 2-[(Trans- 4-Aminocyclohexyl)Amino]-4-{[3-(Trifluoromethyl) Phenyl]Amino}Pyrido[4,3-D]Pyrimidin-5(6H)-One
  21. 4jyw (F: 2) - X-Ray Structure of Human Glutamate Carboxypeptidase II (Gcpii) in Complex with CTT1057
    Other atoms: Zn (2); Ca (1); Cl (1);
  22. 4jz0 (F: 1) - X-Ray Structure of Human Glutamate Carboxypeptidase II (Gcpii) in Complex with CTT1055
    Other atoms: Zn (2); Ca (1); Cl (1);
  23. 4jz1 (F: 1) - Crystal Structure of Matriptase in Complex with Inhibitor
  24. 4k0y (F: 1) - Structure of Pim-1 Kinase Bound to N-(4-Fluorophenyl)-7-Hydroxy-5- (Piperidin-4-Yl)Pyrazolo[1,5-A]Pyrimidine-3-Carboxamide
  25. 4k10 (F: 4) - Crystal Structure of Leshmaniasis Major Farnesyl Diphosphate Synthase in Complex with 3-Fluoro-1-(2-Hydroxy-2,2-Diphosphonoethyl)Pyridinium and MG2+
    Other atoms: Mg (8); Na (6);
  26. 4k18 (F: 1) - Structure of Pim-1 Kinase Bound to 5-(4-Cyanobenzyl)-N-(4- Fluorophenyl)-7-Hydroxypyrazolo[1,5-A]Pyrimidine-3-Carboxamide
  27. 4k1b (F: 2) - Structure of Pim-1 Kinase Bound to N-(5-(2-Fluorophenyl)-1H-Pyrrolo[2, 3-B]Pyridin-3-Yl)-5-((((3R,4R)-3-Fluoropiperidin-4-Yl)Methyl)Amino) Pyrazolo[1,5-A]Pyrimidine-3-Carboxamide
  28. 4k2g (F: 4) - Structure of Pseudomonas Aeruginosa Pvdq Bound to Brd-A33442372
  29. 4k4i (F: 4) - Ternary Crystal Structures of A Human Dna Polymerase Lambda in Complex with Dna and (-)Ftc-Tp.
    Other atoms: As (2); Ca (23);
  30. 4k4o (F: 1) - The Dna Gyrase B Atp Binding Domain of Enterococcus Faecalis in Complex with A Small Molecule Inhibitor
  31. 4k7q (F: 1) - Crystal Structure of Acrb Complexed with Linezolid at 3.5 Resolution
  32. 4k9g (F: 4) - 1.55 A Crystal Structure of Macrophage Migration Inhibitory Factor Bound to Iso-66 and A Related Compound
    Other atoms: Cl (6);
  33. 4k9h (F: 9) - Bace-1 Inhibitor Complex
  34. 4kai (F: 8) - Hcv NS5B GT1B N316 with GSK5852A
  35. 4kap (F: 4) - The Binding of Benzoarylsulfonamide Ligands to Human Carbonic Anhydrase Is Insensitive to Formal Fluorination of the Ligand
    Other atoms: Zn (1);
  36. 4kb7 (F: 2) - Hcv NS5B GT1B N316Y with Cmpd 32
  37. 4kb8 (F: 2) - CK1D in Complex with 1-{4-[3-(4-Fluorophenyl)-1-Methyl-1H-Pyrazol-4- Yl]Pyridin-2-Yl}-N-Methylmethanamine Ligand
  38. 4kba (F: 4) - CK1D in Complex with 9-[3-(4-Fluorophenyl)-1-Methyl-1H-Pyrazol-4-Yl]- 2,3,4,5-Tetrahydropyrido[2,3-F][1,4]Oxazepine Inhibitor
  39. 4kbc (F: 2) - CK1D in Complex with {4-[3-(4-Fluorophenyl)-1H-Pyrazol-4-Yl]Pyridin-2- Yl}Methanol Inhibitor
  40. 4kbi (F: 4) - Hcv NS5B GT1B N316Y with Cmpd 4
Page generated: Fri May 13 23:00:39 2022

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