Fluorine in PDB, part 221 (files: 8801-8840),
PDB 8aau-8b96
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: 8801-8840 (PDB 8aau-8b96).
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8aau (F: 2) - Lim Domain Kinase 1 (LIMK1) Bound to LIMKI3
Other atoms:
Cl (2);
Mg (1);
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8aek (F: 3) - Structure of Compound 14 Bound to CK2ALPHA
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8ahf (F: 4) - Pac-Fragmentdel: Photoactivated Covalent Capture of Dna Encoded Fragments For Hit Discovery
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8alt (F: 2) - Small Molecular Stabilizer For Eralpha and 14-3-3 (1075311)
Other atoms:
Mg (3);
Cl (1);
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8am0 (F: 2) - Crystal Structure of Human T1061E PI3KALPHA in Complex with Its Regulatory Subunit and the Inhibitor Gdc-0077 (Inavolisib)
Other atoms:
Cl (1);
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8an8 (F: 4) - Crystal Structure of Wild-Type C-Met Bound By Compound 7.
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8anh (F: 6) - Structure of the Amyloid-Forming Peptide Lyiqwl From TC5B, Grown From 30% Acetonitrile
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8ani (F: 6) - Structure of the Amyloid-Forming Peptide Lyiqwl From TC5B, Grown From 10% Ethanol
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8ans (F: 2) - Crystal Structure of D1228V C-Met Bound By Compound 1.
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8aqf (F: 2) - Crystal Structure of Human Monoglyceride Lipase with Compound Lei-515
Other atoms:
Cl (2);
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8auu (F: 1) - Human Aldose Reductase Mutant A299G in Complex with A Ligand with An Idd Structure ({5-Fluoro-2-[(3-Nitrobenzyl)Carbamoyl]Phenoxy}Acetic Acid)
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8av3 (F: 2) - Small Molecular Stabilizer For Eralpha and 14-3-3 (1075299)
Other atoms:
Cl (1);
Mg (3);
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8ax3 (F: 4) - Structure of Recombinant Human Beta-Glucocerebrosidase in Complex with L-Carbaxylosyl Fluoride
Other atoms:
Na (1);
Ca (1);
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8axw (F: 2) - The Structure of Mouse Asterc (GRAMD1C) with Ezetimibe
Other atoms:
Cl (1);
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8ayl (F: 14) - Resting State GLUA1/A2 Ampa Receptor in Complex with Tarp Gamma 8 and Ligand Jnj-61432059
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8aym (F: 18) - Resting State GLUA1/A2 Ampa Receptor in Complex with Tarp Gamma 8 and Ligand Jnj-55511118
Other atoms:
Cl (2);
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8ayn (F: 12) - Resting State GLUA1/A2 Ampa Receptor in Complex with Tarp Gamma 8 and Ligand LY3130481
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8ayo (F: 2) - Open State GLUA1/A2 Ampa Receptor in Complex with Tarp Gamma 8 and Ligand Jnj-61432059
Other atoms:
Cl (4);
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8ayy (F: 3) - Poliovirus Type 3 (Strain Saukett) Stabilised Virus-Like Particle (PV3 SC8) in Complex with Gsh and Pleconaril
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8azl (F: 2) - Structure of Sars-Cov-2 NSP3 Macrodomain in Complex with 2'-Deoxy-2'- Fluoro-Adpr
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8b1w (F: 6) - Ndm-1 Metallo-Beta-Lactamase in Complex with Triazole-Based Inhibitor CP35
Other atoms:
Zn (4);
Br (2);
Ca (4);
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8b1z (F: 6) - Ndm-1 Metallo-Beta-Lactamase in Complex with Triazole-Based Inhibitor CP56
Other atoms:
Ca (1);
Zn (4);
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8b20 (F: 3) - Ndm-1 Metallo-Beta-Lactamase in Complex with Triazole-Based Inhibitor CP57
Other atoms:
Ca (3);
Zn (4);
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8b29 (F: 7) - Human Carbonic Anhydrase II Containing 6-Fluorotryptophanes.
Other atoms:
Zn (1);
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8b2t (F: 3) - Sars-Cov-2 Main Protease (Mpro) in Complex with Nirmatrelvir Alkyne
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8b3d (F: 3) - Structure of the Pol II-Tcr-ELOF1 Complex.
Other atoms:
Zn (10);
Mg (2);
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8b3n (F: 1) - Human Aldose Reductase Mutant A299G/L300G in Complex with A Ligand with An Idd Structure (3-({[2-(Carboxymethoxy)-4- Fluorobenzoyl]Amino}Methyl)Benzoic Acid)
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8b3r (F: 1) - Human Aldose Reductase Mutant A299G/L300G in Complex with A Ligand with An Idd Structure ({5-Fluoro-2-[(3-Nitrobenzyl) Carbamoyl]Phenoxy}Acetic Acid)
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8b4q (F: 1) - Ternary Structure of 14-3-3S, Errg Phosphopeptide and Dual-Reactive Compound 5
Other atoms:
Cl (1);
Mg (3);
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8b5y (F: 6) - SHP2 in Complex with Allosteric Imidazopyrazine Inhibitor
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8b66 (F: 1) - Human Aldose Reductase Mutant A299G in Complex with A Ligand with An Idd Structure (3-({[2-(Carboxymethoxy)-4-Fluorobenzoyl]Amino}Methyl) Benzoic Acid)
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8b75 (F: 2) - Crystal Structure of Human Soluble Adenylyl Cyclase in Complex with the Inhibitor Tdi-011861
Other atoms:
Cl (1);
-
8b78 (F: 1) - KRASG12C Ligand Complex
Other atoms:
Mg (1);
Cl (1);
-
8b8u (F: 6) - Crystal Structure of JAK2 JH2-V617F in Complex with Hts-A3
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8b91 (F: 4) - Crystal Structure of Mutant Pparg (C313A) and NCOR2 with An Inverse Agonist (Compound Si-1)
Other atoms:
Cl (1);
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8b92 (F: 4) - Crystal Structure of Pparg and NCOR2 with An Inverse Agonist (Compound Si-2)
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8b93 (F: 10) - Crystal Structure of Pparg and NCOR2 with An Inverse Agonist (Compound 15B)
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8b94 (F: 8) - Crystal Structure of Pparg and NCOR2 with Bay-5516, An Inverse Agonist
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8b95 (F: 6) - Crystal Structure of Pparg and NCOR2 with Bay-9683, An Inverse Agonist
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8b96 (F: 1) - Crystal Structure of the Human BRD4-BD1 Bromodomain in Complex with the Inhibitor CRCM5464
Page generated: Sun Dec 15 10:28:47 2024
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