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Fluorine in PDB, part 133 (files: 5281-5320), PDB 6dkb-6e41

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: 5281-5320 (PDB 6dkb-6e41).
  1. 6dkb (F: 4) - Crystal Structure of Trk-A in Complex with the Pan-Trk Kinase Inhibitor, Compound 10B.
  2. 6dkg (F: 4) - Crystal Structure of Trk-A in Complex with the Pan-Trk Kinase Inhibitor, Compound 13B.
  3. 6dki (F: 5) - Crystal Structure of Trk-A in Complex with the Pan-Trk Kinase Inhibitor, Compound 19.
  4. 6dko (F: 2) - Crystal Structure of Mycobacterium Tuberculosis Malate Synthase in Complex with 2,6-F-Phenyldiketoacid
    Other atoms: Mg (3);
  5. 6dkw (F: 6) - Crystal Structure of Trk-A in Complex with the Pan-Trk Kinase Inhibitor, Compound 3.
  6. 6dmg (F: 2) - A Multiconformer Ligand Model of EK6 Bound to ERK2
    Other atoms: Cl (4);
  7. 6dmi (F: 6) - A Multiconformer Ligand Model of 5T5 Bound to Bace-1
    Other atoms: Cl (3); Na (2);
  8. 6dnp (F: 2) - Crystal Structure of Mycobacterium Tuberculosis Malate Synthase in Complex with 2-F-3-Methyl-6-F-Phenyldiketoacid
    Other atoms: Mg (2);
  9. 6dpq (F: 1) - Mapping the Binding Trajectory of A Suicide Inhibitor in Human Indoleamine 2,3-Dioxygenase 1
    Other atoms: Fe (1); Cl (1);
  10. 6dpr (F: 2) - Mapping the Binding Trajectory of A Suicide Inhibitor in Human Indoleamine 2,3-Dioxygenase 1
    Other atoms: Fe (1); Cl (2);
  11. 6dpy (F: 2) - X-Ray Crystal Structure of Ampc Beta-Lactamase with Inhibitor
  12. 6drw (F: 2) - JAK2 JH1 in Complex with Jnj-7706621 (Crystal Form 2)
  13. 6dte (F: 6) - Glcnac-Inspired Cyclophellitol Bound to Nagz
  14. 6dtw (F: 2) - Hiv-1 Reverse Transcriptase Y181C Mutant in Complex with Jlj 578
    Other atoms: Mg (1);
  15. 6dtx (F: 2) - Wildtype Hiv-1 Reverse Transcriptase in Complex with Jlj 578
  16. 6duc (F: 3) - Crystal Structure of Mutant Beta-K167T Tryptophan Synthase in Complex with Inhibitor N-(4'-Trifluoromethoxybenzenesulfonyl)-2-Amino-1- Ethylphosphate (F9F) at the Alpha-Site, Cesium Ion at the Metal Coordination Site, and 2-Aminophenol Quinonoid (1D0) at the Beta-Site
    Other atoms: Cs (4); Cl (11);
  17. 6due (F: 4) - Toxoplasma Gondii Myoa, A Class-Xiv Myosin, in the Pre-Powerstroke State
    Other atoms: Mg (1); Al (1);
  18. 6duk (F: 6) - Egfr with An Allosteric Inhibitor
    Other atoms: Mg (6);
  19. 6dum (F: 1) - ALDH1A1 N121S in Complex with 6-{[(3-Fluorophenyl)Methyl]Sulfanyl}-2- (Oxetan-3-Yl)-5-Phenyl-2,5-Dihydro-4H-Pyrazolo[3,4-D]Pyrimidin-4-One (Compound 13G)
    Other atoms: Yb (2); Cl (7);
  20. 6dup (F: 3) - Crystal Structure of Pxr in Complex with Compound 7
  21. 6duq (F: 36) - Structure of A Rho-Nusg Kow Domain Complex
    Other atoms: Mg (12);
  22. 6dvo (F: 1) - Crystal Structure of Danio Rerio Histone Deacetylase 6 Catalytic Domain 2 in Complex with Bavarostat
    Other atoms: K (2); Zn (1);
  23. 6dw5 (F: 8) - SAMHD1 Bound to Gemcitabine-Tp in the Catalytic Pocket
    Other atoms: Ni (1); Mg (10); Na (4);
  24. 6dwd (F: 8) - SAMHD1 Bound to Clofarabine-Tp in the Catalytic Pocket and Allosteric Pocket
    Other atoms: Mg (10); Na (23);
  25. 6dwe (F: 12) - Crystal Structure of Tryptophan Synthase From M. Tuberculosis - Aminoacrylate- and BRD0059-Bound Form
    Other atoms: Cs (9);
  26. 6dwk (F: 4) - SAMHD1 Bound to Fludarabine-Tp in the Catalytic Pocket
    Other atoms: Mg (9); Na (23);
  27. 6dxx (F: 3) - Human N-Acylethanolamine-Hydrolyzing Acid Amidase (Naaa) in Complex with Non-Covalent Benzothiazole-Piperazine Inhibitor ARN19702, in Presence of Triton X-100
    Other atoms: Cl (12);
  28. 6dxz (F: 1) - Rabbit N-Acylethanolamine-Hydrolyzing Acid Amidase (Naaa) in Complex with Non-Covalent Benzothiazole-Piperazine Inhibitor ARN19702, in Presence of Triton X-100
    Other atoms: K (1);
  29. 6dz5 (F: 2) - Citrobacter Freundii Tyrosine Phenol-Lyase F448A Mutant Complexed with L-Alanine
    Other atoms: K (2);
  30. 6dzo (F: 3) - Crystal Structure of Salmonella Typhimurium Tryptophan Synthase Mutant Beta-Q114A with 2-({[4-(Trifluoromethoxy)Phenyl]Sulfonyl}Amino)Ethyl Dihydrogen Phosphate (F9F) at the Alpha-Site, Cesium Ion at the Metal Coordination Site, and [3-Hydroxy-2-Methyl-5-Phosphonooxymethyl- Pyridin-4-Ylmethyl]-Serine (Pls) at the Beta-Site.
    Other atoms: Cs (4); Cl (13);
  31. 6dzw (F: 1) - Cryo-Em Structure of the TS2-Inactive Human Serotonin Transporter in Complex with Paroxetine and 15B8 Fab and 8B6 Scfv
  32. 6e0r (F: 1) - Halk in Complex with Compound 7 N-((1S)-1-(5-Fluoropyridin-2-Yl) Ethyl)-1-(5-Methyl-1H-Pyrazol-3-Yl)-3-(Oxetan-3-Ylsulfonyl)-1H- Pyrrolo[2,3-B]Pyridin-6-Amine
  33. 6e22 (F: 2) - Displacement of WDR5 From Chromatin By A Pharmacological Win Site Inhibitor with Picomolar Affinity
  34. 6e23 (F: 2) - Displacement of WDR5 From Chromatin By A Pharmacological Win Site Inhibitor with Picomolar Affinity
    Other atoms: Cl (4);
  35. 6e2v (F: 3) - Mddef in Complex with Mvapp, ADPBEF3 and Magnesium
    Other atoms: Mg (2);
  36. 6e3e (F: 2) - Structure of Rorgt in Complex with A Novel Inverse Agonist.
  37. 6e3s (F: 3) - Crystal Structure of the Heterodimeric Hif-2 Complex with Antagonist PT2385
  38. 6e3z (F: 16) - Structure of Bace-1 in Complex with Ligand 8
    Other atoms: Cl (8);
  39. 6e40 (F: 3) - Crystal Structure of the Indoleamine 2,3-Dioxygenase 1 (IDO1) in Complexed with Ferric Heme and Epacadostat
    Other atoms: Br (3); Fe (4);
  40. 6e41 (F: 6) - Crystal Structure of Human Indoleamine 2,3-Dioxygenase 1 (IDO1) in Complex with Ferric Heme and An Epacadostat Analog
    Other atoms: Br (6); Fe (4);
Page generated: Tue Dec 1 09:27:08 2020

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