Fluorine in PDB, part 82 (files: 3241-3280),
PDB 4u80-4uwf
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: 3241-3280 (PDB 4u80-4uwf).
-
4u80 (F: 1) - Mek 1 Kinase Bound to G799
Other atoms:
Mg (1);
-
4u81 (F: 1) - MEK1 Kinase Bound to Small Molecule Inhibitor G659
Other atoms:
Mg (1);
-
4u8w (F: 4) - Hiv-1 Wild Type Protease with Grl-050-10A (A Gem-Difluoro-Bis- Tetrahydrofuran As P2-Ligand)
Other atoms:
Cl (3);
Na (1);
-
4u93 (F: 1) - Crystal Structure of HSP90-Alpha N-Domain Bound to the Inhibitor Nvp- HSP990
-
4ua7 (F: 12) - Ctx-M-14 Class A Beta-Lactamase in Complex with A Non-Covalent Inhibitor at Sub-Angstrom Resolution
-
4uaa (F: 12) - Ctx-M-14 Class A Beta-Lactamase in Complex with A Non-Covalent Inhibitor at Sub-Angstrom Resolution
-
4ube (F: 1) - Crystal Structure of M Tuberculosis Adenosine Kinase Complexed with 2- Fluro Adenosine
-
4uce (F: 1) - N-Terminal Globular Domain of the Rsv Nucleoprotein in Complex with the Nucleoprotein Phosphoprotein Interaction Inhibitor M72
-
4uda (F: 1) - Mr in Complex with Dexamethasone
-
4udc (F: 1) - Gr in Complex with Dexamethasone
-
4ufu (F: 6) - Crystal Structure of Human Tankyrase 2 in Complex with Ta-12
Other atoms:
Zn (2);
-
4uga (F: 1) - Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 6-((3-(((2-(3-Fluorophenyl)Ethyl)Amino)Methyl)Phenoxy)Methyl)-4- Methylpyridin-2-Amine
Other atoms:
Fe (1);
Cl (1);
-
4ugb (F: 1) - Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with 6-(((5-(((2-(3-Fluorophenyl)Ethyl)Amino)Methyl)Pyridin-3-Yl)Oxy) Methyl)-4-Methylpyridin-2-Amine
Other atoms:
Fe (1);
Cl (1);
-
4ugl (F: 1) - Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with N1-(3-(2-(6-Amino-4-Methylpyridin-2-Yl)Ethyl)-5-Fluorophenyl)-N1- Cyclopropyl-N2-Methylethane-1,2-Diamine
Other atoms:
Fe (1);
Cl (1);
-
4ugx (F: 1) - Structure of Bacillus Subtilis Nitric Oxide Synthase in Complex with N-(3-((Ethyl(2-(3-Fluorophenyl)Ethyl)Amino)Methyl)Phenyl)Thiophene-2- Carboximidamide
Other atoms:
Fe (1);
Cl (1);
-
4uh2 (F: 6) - Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with N1-(3-(2-(6-Amino-4-Methylpyridin-2-Yl)Ethyl)- 5-(Trifluoromethyl)Phenyl)-N1,N2-Dimethylethane-1,2-Diamine
Other atoms:
Fe (2);
Zn (1);
-
4uh3 (F: 2) - Structure of Rat Neuronal Nitric Oxide Synthase Heme Domain in Complex with N1-(3-(2-(6-Amino-4-Methylpyridin-2-Yl) Ethyl)-5-Fluorophenyl)-N1,N2-Dimethylethane-1,2-Diamine
Other atoms:
Fe (2);
Zn (1);
-
4uh9 (F: 3) - Structure of Bovine Endothelial Nitric Oxide Synthase Heme Domain in Complex with N1-(3-(2-(6-Amino-4-Methylpyridin-2- Yl)Ethyl)-5-Fluorophenyl)-N1,N2-Dimethylethane-1,2-Diamine
Other atoms:
Zn (1);
As (2);
Fe (2);
-
4uhi (F: 16) - Human Sterol 14-Alpha Demethylase (CYP51) in Complex with Vfv in C121 Space Group
Other atoms:
Fe (4);
-
4uhl (F: 32) - Human Sterol 14-Alpha Demethylase (CYP51) in Complex with Vfv in P1 Space Group
Other atoms:
Fe (8);
-
4ui3 (F: 6) - Crystal Structure of Human Tankyrase 2 in Complex with Ta-26
Other atoms:
Zn (2);
-
4ui6 (F: 6) - Crystal Structure of Human Tankyrase 2 in Complex with Ta-47
Other atoms:
Zn (2);
-
4ui8 (F: 6) - Crystal Structure of Human Tankyrase 2 in Complex with Ta-55
Other atoms:
Zn (2);
-
4uiv (F: 3) - Bromodomain of Human BRD9 with N-(1,1-Dioxo-1-Thian-4-Yl)-5- Methyl-4-Oxo-7-3-(Trifluoromethyl)Phenyl-4H,5H-Thieno-3,2- C-Pyridine-2-Carboximidamide
-
4uiw (F: 3) - Bromodomain of Human BRD9 with N-(1,1-Dioxo-1-Thian-4-Yl)-5- Ethyl-4-Oxo-7-3-(Trifluoromethyl)Phenyl-4H,5H-Thieno-3,2-C- Pyridine-2-Carboximidamide
-
4uiy (F: 6) - N-Terminal Bromodomain of Human BRD4 with N-(1,1-Dioxo-1- Thian-4-Yl)-5-Methyl-4-Oxo-7-3-(Trifluoromethyl)Phenyl-4H, 5H-Thieno-3,2-C-Pyridine-2-Carboximidamide
-
4uj9 (F: 3) - Protein Kinase A in Complex with An Inhibitor
-
4ujb (F: 1) - Protein Kinase A in Complex with An Inhibitor
-
4ukd (F: 2) - Ump/Cmp Kinase From Slime Mold Complexed with Adp, Udp, Beryllium Fluoride
Other atoms:
Mg (1);
-
4umr (F: 1) - Structure of Melk in Complex with Inhibitors
-
4umv (F: 3) - Crystal Structure of A Zinc-Transporting Pib-Type Atpase in the E2P State
Other atoms:
Mg (1);
-
4umw (F: 4) - Crystal Structure of A Zinc-Transporting Pib-Type Atpase in E2.Pi State
Other atoms:
Mg (1);
Al (1);
-
4und (F: 4) - Human ARTD1 (PARP1) - Catalytic Domain in Complex with Inhibitor Talazoparib
Other atoms:
Na (1);
-
4unq (F: 6) - Mtb Tmk in Complex with Compound 36
Other atoms:
Na (1);
-
4uqh (F: 3) - Crystal Structure of Trypanosoma Cruzi CYP51 Bound to the Inhibitor (R)-N-(3-(1H-Indol-3-Yl)-1-Oxo-1-(Pyridin-4- Ylamino)Propan-2-Yl)-4-(4-(3,4-Difluorophenyl)Piperazin-1- Yl)-2-Fluorobenzamide.
Other atoms:
Fe (1);
-
4uqj (F: 12) - Cryo-Em Density Map of GLUA2EM in Complex with ZK200775
-
4uvd (F: 3) - Discovery of Pyrimidine Isoxazoles Inha in Complex with Compound 6
Other atoms:
Mg (1);
-
4uvr (F: 1) - Binding Mode, Selectivity and Potency of N-Indolyl- Oxopyridinyl-4-Amino-Propanyl-Based Inhibitors Targeting Trypanosoma Cruzi CYP51
Other atoms:
Fe (1);
Cl (1);
-
4uvx (F: 2) - Crystal Structure of Human Tankyrase 2 in Complex with 3-(4- Chlorophenyl)-5-Fluoro-1,2-Dihydroisoquinolin-1-One
Other atoms:
Cl (2);
Zn (2);
-
4uwf (F: 5) - Discovery of (2S)-8-((3R)-3-Methylmorpholin-4-Yl)-1-(3- Methyl-2-Oxo-Butyl)-2-(Trifluoromethyl)-3,4-Dihydro-2H- Pyrimido(1,2-A)Pyrimidin-6-One: A Novel Potent and Selective Inhibitor of VPS34 For the Treatment of Solid Tumors
Page generated: Fri May 13 23:03:54 2022
|
