Fluorine in PDB, part 75 (files: 2961-3000),
PDB 4ncj-4o16
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: 2961-3000 (PDB 4ncj-4o16).
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4ncj (F: 12) - Crystal Structure of Pyrococcus Furiosis RAD50 R805E Mutation with Adp Beryllium Flouride
Other atoms:
Mg (4);
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4ncm (F: 1) - Influenza Polymerase Basic Protein 2 (PB2) Bound to A Small-Molecule Inhibitor
Other atoms:
Cl (1);
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4ncr (F: 6) - Crystal Structure of M. Tuberculosis DPRE1 in Complex with PBTZ169
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4ncs (F: 1) - Human Sialidase 2 in Complex with 2,3-Difluorosialic Acid (Covalent Intermediate)
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4nfh (F: 10) - V207A Horse Liver Alcohol Dehydrogenase E Complexed with Nad and 2,3, 4,5,6-Pentafluorobenzyl Alcohol
Other atoms:
Zn (4);
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4nfs (F: 6) - V203A Horse Liver Alcohol Dehydrogenase E Complexed with Nad and 2,2, 2-Trifluoroethanol
Other atoms:
Zn (4);
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4ng5 (F: 10) - V203A Horse Liver Alcohol Dehydrogenase E Complexed with Nad+ and 2,3, 4,5,6-Pentafluorobenzyl Alcohol
Other atoms:
Zn (4);
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4nh7 (F: 6) - Correlation Between Chemotype-Dependent Binding Conformations of HSP90 Alpha/Beta and Isoform Selectivity
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4nh8 (F: 1) - Correlation Between Chemotype-Dependent Binding Conformations of HSP90 Alpha/Beta and Isoform Selectivity
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4nh9 (F: 1) - Correlation Between Chemotype-Dependent Binding Conformations of HSP90 Alpha/Beta and Isoform Selectivity
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4nhc (F: 6) - Crystal Structure of the Hiv-1 Neutralizing Antibody 4E10 Fab Fragment in Complex with A Hydrocarbon-Stapled Peptide Containing the 4E10 Epitope on GP41.
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4nhv (F: 6) - Crystal Structure of B. Anthracis Dhps with Interfacial Compound 4: 5- (Trifluoromethyl)-1,2-Benzoxazol-3-Amine
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4nic (F: 12) - Crystal Structure of Klebsiella Pneumoniae Rsta BEF3-Activated N- Terminal Receiver Domain
Other atoms:
Mg (4);
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4nil (F: 6) - Crystal Structure of B. Anthracis Dhps with Compound 5: 4- [(Trifluoromethyl)Sulfanyl]Benzamide
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4nir (F: 9) - Crystal Structure of B. Anthracis Dhps with Compound 6: 3-[6- (Trifluoromethyl)-1H-Benzimidazol-2-Yl]Propan-1-Ol
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4nju (F: 6) - Crystal Structure of Multidrug-Resistant Clinical Isolate A02 Hiv-1 Protease in Complex with Tipranavir
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4nl1 (F: 6) - Crystal Structure of B. Anthracis Dhps with Compound 11: (E)-N-[4- (Trifluoromethyl)Benzyl]-1-[4-(Trifluoromethyl)Phenyl]Methanimine
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4nld (F: 1) - Crystal Structure of the Hepatitis C Virus NS5B Rna-Dependent Rna Polymerase Complex with Bms-791325 Also Known As (1AR,12BS)-8- Cyclohexyl-N-(Dimethylsulfamoyl)-11-Methoxy-1A-{[(1R,5S)-3-Methyl-3, 8-Diazabicyclo[3.2.1]Oct-8-Yl]Carbonyl}-1,1A,2,12B- Tetrahydrocyclopropa[D]Indolo[2,1-A][2]Benzazepine-5-Carboxamide and 2-(4-Fluorophenyl)-N-Methyl-6-[(Methylsulfonyl)Amino]-5-(Propan-2- Yloxy)-1-Benzofuran-3-Carboxamide
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4nlf (F: 3) - 2'-Trifluoromethylthio-2'-Deoxycytidine-Modified Srl
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4nmg (F: 3) - 2'-Trifluoromethylthio-2'-Deoxyuridine-Modified Srl
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4nms (F: 2) - Cftr Associated Ligand (Cal)Pdz Domain Bound to Peptide ICAL36(Flb-K- 1) (Ansrwpts[4-Fluorobenzoic-Acyl-K]I)
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4nmt (F: 6) - Cftr Associated Ligand (Cal) Pdz Domain Bound to Peptide ICAL36(Tfa-K- 1) (Ansrwpts[Tfa-Acyl-K]I)
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4nqa (F: 6) - Crystal Structure of Liganded Hrxr-Alpha/Hlxr-Beta Heterodimer on Dna
Other atoms:
Cl (2);
Zn (8);
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4nst (F: 6) - Crystal Structure of Human CDK12/Cyclin K in Complex with Adp-Aluminum Fluoride
Other atoms:
Mg (7);
Al (2);
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4nu1 (F: 3) - Crystal Structure of A Transition State Mimic of the Gsk-3/Axin Complex Bound to Phosphorylated N-Terminal Auto-Inhibitory PS9 Peptide
Other atoms:
Mg (2);
Al (1);
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4nus (F: 2) - RSK2 N-Terminal Kinase in Complex with LJH685
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4nv0 (F: 6) - Crystal Structure of Cytosolic 5'-Nucleotidase Iiib (Cn-Iiib) Bound to 7-Methylguanosine
Other atoms:
Mg (4);
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4nw5 (F: 1) - RSK2 N-Terminal Kinase in Complex with 2-Amino-7-Substituted Benzoxazole Compound 8
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4nxh (F: 3) - 2'-Trifluoromethylthiouridine-Modified E. Coli 23S Rrna Sarcin Ricin Loop
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4nxo (F: 2) - Crystal Structure of Insulin Degrading Enzyme in Complex with BDM44768
Other atoms:
Zn (2);
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4nxs (F: 2) - Crystal Structure of Human Alpha-Galactosidase A in Complex with 1- Deoxygalactonojirimycin-Pfpht
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4nxy (F: 3) - Crystal Structure of the Gnat Domain of S. Lividans Pat
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4ny4 (F: 3) - Crystal Structure of CYP3A4 in Complex with An Inhibitor
Other atoms:
Fe (1);
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4nz2 (F: 6) - Crystal Structure of CYP2C9 in Complex with An Inhibitor
Other atoms:
Br (2);
Fe (2);
Cl (2);
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4o0o (F: 1) - Crystal Structure of the Complex of Type 1 Ribosome Inactivating Protein From Momordica Balsamina with 5-Fluorouracil at 2.59 A Resolution
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4o0z (F: 4) - Structural and Biochemical Analyses of the Catalysis and Potency Impact of Inhibitor Phosphoribosylation By Human Nicotinamide Phosphoribosyltransferase
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4o10 (F: 4) - Structural and Biochemical Analyses of the Catalysis and Potency Impact of Inhibitor Phosphoribosylation By Human Nicotinamide Phosphoribosyltransferase
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4o13 (F: 6) - The Crystal Structure of Nampt in Complex with Gne-618
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4o15 (F: 6) - The Crystal Structure of A Mutant Nampt (S165F) in Complex with Gne- 618
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4o16 (F: 2) - Structural Basis For Resistance to Diverse Classes of Nampt Inhibitors
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