Fluorine in PDB, part 196 (files: 7801-7840),
PDB 7ly8-7m8p
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: 7801-7840 (PDB 7ly8-7m8p).
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7ly8 (F: 9) - The Internal Aldimine Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with Two Molecules of N-(4'- Trifluoromethoxybenzoyl)-2-Amino-1-Ethylphosphate (F6F) Inhibitor at the Enzyme Alpha-Site, A Single F6F Molecule at the Enzyme Beta-Site, and Sodium Ion at the Metal Coordination Site at 1.55 Angstrom Resolution. One of the Beta-Q114 Rotamer Conformations Allows A Hydrogen Bond to Form with the Plp Oxygen at the Position 3 in the Ring
Other atoms:
Na (1);
Cl (5);
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7lza (F: 3) - Activated Form of Vanr From S. Coelicolor
Other atoms:
Mg (1);
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7lzd (F: 1) - Crystal Structure of SETD2 Bound to Compound 35
Other atoms:
Zn (3);
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7lzf (F: 1) - Crystal Structure of SETD2 Bound to Compound 57
Other atoms:
Zn (3);
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7lzu (F: 8) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 12B
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7lzv (F: 4) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 19B
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7lzw (F: 4) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 20B (Deuterated Analog of 19B)
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7m00 (F: 8) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 13C
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7m01 (F: 8) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 14C
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7m02 (F: 2) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 17C
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7m03 (F: 2) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 18C
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7m04 (F: 20) - Structure of Sars-Cov-2 3CL Protease in Complex with Inhibitor 21C
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7m0m (F: 8) - HPK1 in Complex with Compound 1
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7m0n (F: 4) - The Crystal Structure of Wild Type Pa Endonuclease (2009/H1N1/California) in Complex with Raltegravir
Other atoms:
Mn (8);
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7m0t (F: 1) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib
Other atoms:
Cl (1);
Mg (2);
Br (1);
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7m0u (F: 2) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Binimetinib
Other atoms:
Br (1);
Mg (2);
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7m0v (F: 3) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Cobimetinib
Other atoms:
I (1);
Mg (2);
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7m0w (F: 1) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib
Other atoms:
Mg (2);
I (1);
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7m0x (F: 3) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and PD0325901
Other atoms:
Mg (2);
I (1);
Cl (1);
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7m0y (F: 1) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Trametinib
Other atoms:
I (1);
Mg (2);
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7m0z (F: 1) - Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and CH5126766
Other atoms:
Mg (2);
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7m1k (F: 4) - Crystal Structure of Dehaloperoxidase B in Complex with 2,6- Difluorophenol
Other atoms:
Fe (2);
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7m2f (F: 1) - CDK2 with Compound 14 Inhibitor with Carboxylate
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7m2l (F: 6) - The Internal Aldimine Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with N-(4'-Trifluoromethoxybenzoyl)-2- Amino-1-Ethylphosphate (F6F) Inhibitor at the Alpha-and Beta-Site, Sodium Ion at the Metal Coordination Site, and Another F6F Molecule at the Enzyme Beta-Site at 1.60 Angstrom Resolution. Two of the Beta- Q114 Rotamer Conformations Allows A Hydrogen Bond to Form with the Plp Oxygen at the Position 3 in the Ring
Other atoms:
Cl (6);
Na (2);
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7m2n (F: 10) - Crystal Structure of Human Lactate Dehydrogenase A with Inhibitor Compound 15
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7m2o (F: 2) - Crystal Structure of Human Glycolate Oxidase with Inhibitor Compound 15
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7m3f (F: 6) - Asymmetric Activation of the Calcium Sensing Receptor Homodimer
Other atoms:
Ca (4);
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7m3s (F: 6) - The Internal Aldimine Form of the Wild-Type Salmonella Typhimurium Tryptophan Synthase in Complex with N-(4'-Trifluoromethoxybenzoyl)-2- Amino-1-Ethylphosphate (F6F) Inhibitor at the Alpha-and Beta-Site, Sodium Ion at the Metal Coordination Site, and Another F6F Molecule at the Enzyme Beta-Site at 1.55 Angstrom Resolution. One of the Beta- Q114 Rotamer Conformations Allows A Hydrogen Bond to Form with the Plp Oxygen at the Position 3 in the Ring
Other atoms:
Cl (2);
Na (2);
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7m4p (F: 1) - Multidrug Efflux Pump Adej with Eravacylcine Bound
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7m4t (F: 1) - Menin Bound to M-1121
Other atoms:
Pr (5);
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7m4u (F: 1) - A. Baumannii Ribosome-Eravacycline Complex: 30S
Other atoms:
Mg (83);
-
7m4v (F: 2) - A. Baumannii Ribosome-Eravacycline Complex: 50S
Other atoms:
Mg (159);
Zn (1);
-
7m5x (F: 3) - Human ATP13A2 in the Outward-Facing E2 State Bound to Spermine and Beryllium Fluoride
Other atoms:
Mg (1);
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7m5y (F: 4) - Human ATP13A2 in the Outward-Facing E2 State Bound to Spermine and Magnesium Fluoride
Other atoms:
Mg (2);
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7m5z (F: 2) - Crystal Structure of the Mertk Kinase Domain in Complex with Inhibitor MIPS15692
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7m63 (F: 4) - Crystal Structure of the Indoleamine 2,3-Dioxygenagse 1 (IDO1) Complexed with Iacs-70099
Other atoms:
Cl (2);
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7m7d (F: 6) - Crystal Structure of the Indoleamine 2,3-Dioxygenagse 1 (IDO1) Complexed with Iacs-8968
Other atoms:
Fe (2);
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7m7n (F: 1) - Human Dna Pol Eta with 2'-Fa-Ended Primer and Dampnpp
Other atoms:
Mg (2);
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7m8o (F: 1) - Crystal Structure of the Sars-Cov-2(2019-Ncov) Main Protease in Complex with Compound 19
Other atoms:
Cl (1);
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7m8p (F: 1) - Crystal Structure of the Sars-Cov-2(2019-Ncov) Main Protease in Complex with Compound 23
Other atoms:
Cl (2);
Page generated: Sun Dec 15 10:27:52 2024
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