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Fluorine in PDB, part 166 (files: 6601-6640), PDB 6vpl-6w5x

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: 6601-6640 (PDB 6vpl-6w5x).
  1. 6vpl (F: 6) - TPX2 Residues 7-20 Fused to Aurora A Residues 116-389 with C290 Disulfide Bonded to Compound 7-80, and in Complex with Amp-Pnp
    Other atoms: Mg (4);
  2. 6vqf (F: 8) - Crystal Structure of Rar-Related Orphan Receptor C (Nhis-Rorgt(244- 487)-L6-SRC1(678-692)) in Complex with An Inverse Agonist
  3. 6vql (F: 4) - Crystal Structure of Interleukin-1 Receptor-Associated Kinase 4 (IRAK4-Wt) Complex with A Nicotinamide Inhibitor
  4. 6vqr (F: 25) - Cryoem Structure of the Pffnt-Inhibitor Complex
  5. 6vqs (F: 1) - Hiv Integrase Core Domain (in) in Complex with [5-(3-Fluorophenyl)-1- Benzofuran-3-Yl]Acetic Acid
    Other atoms: I (4);
  6. 6vrh (F: 1) - Cryo-Em Structure of the Wild-Type Human Serotonin Transporter Complexed with Paroxetine and 8B6 Fab
    Other atoms: Cl (1);
  7. 6vrv (F: 1) - Discovery of SARXXXX92, A Pan-Pim Kinase Inhibitor, Efficacious in A KG1 Tumor Model
    Other atoms: Cl (1);
  8. 6vsg (F: 3) - Mycobacterium Tuberculosis Dihydrofolate Reductase in Complex with 4- (Trifluoromethyl)Benzene-1,2-Diamine(Fragment 17)
    Other atoms: Co (2);
  9. 6vsw (F: 8) - Optimization and Biological Evaluation of Thiazole-Bis-Amide Inverse Agonists of Rorgt
    Other atoms: Cl (4);
  10. 6vtn (F: 4) - Crystal Structure of Plasmodium Falciparum Dihydroorotate Dehydrogenase Bound with Inhibitor DSM557
  11. 6vty (F: 12) - Crystal Structure of Plasmodium Falciparum Dihydroorotate Dehydrogenase Bound with Inhibitor DSM483
  12. 6vv6 (F: 2) - Mycobacterium Tuberculosis Dihydrofolate Reductase in Complex with JEB113
    Other atoms: Co (2);
  13. 6vvb (F: 3) - Mycobacterium Tuberculosis Dihydrofolate Reductase in Complex with 6- Methyl-5-(4-Phenylthiazol-2-Yl)-2- (Trifluoromethyl)Nicotinic Acid (Fragment 10)
  14. 6vxr (F: 2) - Structure of Maternal Embryonic Leucine Zipper Kinase Bound to LDSM276
  15. 6vxu (F: 8) - Structure of Human Vaccinia-Related Kinase 1 (VRK1) Bound to ACH471
  16. 6vz4 (F: 30) - Cryo-Em Structure of STH1-ARP7-ARP9-RTT102 Bound to the Nucleosome in Adp Beryllium Fluoride State
    Other atoms: Mg (10);
  17. 6vzh (F: 4) - Structure of Human Vaccinia-Related Kinase 1 (VRK1) Bound to LDSM311
  18. 6w0n (F: 6) - Structure of Khk in Complex with Compound 2
  19. 6w0w (F: 6) - Structure of Khk in Complex with Compound 3
  20. 6w0x (F: 6) - Structure of Khk in Complex with Compound 4 (6-[(1~{S},5~{R})-6- (Hydroxymethyl)-3-Azabicyclo[3.1.0]Hexan-3-Yl]-2-[(2~{S},3~{R})-2- Methyl-3-Oxidanyl-Azetidin-1-Yl]-4-(Trifluoromethyl)Pyridine-3- Carbonitrile)
  21. 6w0y (F: 6) - Structure of Khk in Complex with Compound 6 (2-[(1~{R},5~{S})-3-[5- Cyano-6-[(2~{S},3~{R})-2-Methyl-3-Oxidanyl-Azetidin-1-Yl]-4- (Trifluoromethyl)Pyridin-2-Yl]-3-Azabicyclo[3.1.0]Hexan-6-Yl]Ethanoic Acid)
  22. 6w0z (F: 6) - Structure of Khk in Complex with Compound 8 (2-[(1~{S},5~{R})-3-[2- [(2~{S})-2-Methylazetidin-1-Yl]-6-(Trifluoromethyl)Pyrimidin-4-Yl]-3- Azabicyclo[3.1.0]Hexan-6-Yl]Ethanoic Acid)
  23. 6w29 (F: 2) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC013)
  24. 6w2a (F: 8) - 1.65 A Resolution Structure of Sars-Cov 3CL Protease in Complex with Inhibitor 7J
  25. 6w2j (F: 4) - CPS1 Bound to Allosteric Inhibitor H3B-374
    Other atoms: Zn (2);
  26. 6w2n (F: 3) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC009)
  27. 6w35 (F: 4) - A New Autotaxin Inhibitor For the Treatment of Idiopathic Pulmonary Fibrosis: A Clinical Candidate Discovered Using Dna-Encoded Chemistry
    Other atoms: Mg (2); Zn (2); I (5); Ca (2); Cl (12);
  28. 6w3k (F: 2) - Structure of Unphosphorylated Human IRE1 Bound to G-9807
  29. 6w45 (F: 1) - Crystal Structure of HAO1 in Complex with Biaryl Acid Inhibitor - Compound 3
    Other atoms: Cl (2);
  30. 6w49 (F: 1) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC010)
  31. 6w4g (F: 2) - Hepatitis C Virus Polymerase NS5B with Ro Inhibitor For Sar Studies
  32. 6w4k (F: 2) - Crystal Structure of Lysine Specific Demethylase 1 (LSD1) with Cc- 90011
  33. 6w4x (F: 6) - Holocomplex of E. Coli Class Ia Ribonucleotide Reductase with Gdp and Ttp
    Other atoms: Mg (2); Fe (4);
  34. 6w4y (F: 3) - Structure of Full-Length Human Lambda-6A Light Chain Jto in Complex with Hydantoin Stabilizer
  35. 6w50 (F: 2) - Factor Xia in Complex with the Inhibitor Methyl ((10R,14S)- 14-(4-(3- Chloro-2,6-Difluorophenyl)-6-Oxo-3,6-Dihydro- 1(2H)-Pyridinyl)-10- Methyl-9-Oxo-8,16- Diazatricyclo[13.3.1.0~2,7~]Nonadeca-1(19),2,4,6, 15,17- Hexaen-5-Yl)Carbamate
    Other atoms: Cl (1);
  36. 6w53 (F: 5) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC070)
    Other atoms: Cl (1);
  37. 6w56 (F: 4) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC062)
  38. 6w57 (F: 4) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC069)
    Other atoms: Cl (1);
  39. 6w59 (F: 5) - Trypanosoma Cruzi Malic Enzyme in Complex with Inhibitor (MEC063)
  40. 6w5x (F: 1) - Crystal Structure of Human Polymerase Eta Complexed with N7- Benzylguanine and Dctp*
    Other atoms: Mn (2);
Page generated: Fri May 13 23:26:41 2022

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