Electrostatic models for computing protonation and redox equilibria in proteins GM Ullmann, EW Knapp European Biophysics Journal 28 (7), 533-551, 1999 | 314 | 1999 |
Anaerobic microbial degradation of hydrocarbons: from enzymatic reactions to the environment R Rabus, M Boll, J Heider, RU Meckenstock, W Buckel, O Einsle, ... Journal of molecular microbiology and biotechnology 26 (1-3), 5-28, 2016 | 291 | 2016 |
A novel view of pH titration in biomolecules A Onufriev, DA Case, GM Ullmann Biochemistry 40 (12), 3413-3419, 2001 | 244 | 2001 |
pH modulates the quinone position in the photosynthetic reaction center from Rhodobacter sphaeroides in the neutral and charge separated states J Koepke, EM Krammer, AR Klingen, P Sebban, GM Ullmann, G Fritzsch Journal of Molecular Biology 371 (2), 396-409, 2007 | 171 | 2007 |
Computational Simulation and Analysis of Dynamic Association between Plastocyanin and Cytochrome f. Consequences for the Electron-Transfer Reaction GM Ullmann, EW Knapp, NM Kostić Journal of the American Chemical Society 119 (1), 42-52, 1997 | 166 | 1997 |
Structure of the non-redox-active tungsten/[4Fe: 4S] enzyme acetylene hydratase GB Seiffert, GM Ullmann, A Messerschmidt, B Schink, PMH Kroneck, ... Proceedings of the National Academy of Sciences 104 (9), 3073-3077, 2007 | 163 | 2007 |
Differential effects of cholesterol, ergosterol and lanosterol on a dipalmitoyl phosphatidylcholine membrane: a molecular dynamics simulation study Z Cournia, GM Ullmann, JC Smith The journal of physical chemistry B 111 (7), 1786-1801, 2007 | 154 | 2007 |
Visualization of the Encounter Ensemble of the Transient Electron Transfer Complex of Cytochrome c and Cytochrome c Peroxidase Q Bashir, AN Volkov, GM Ullmann, M Ubbink Journal of the American chemical Society 132 (1), 241-247, 2010 | 148 | 2010 |
Density functional calculation of pK a values and redox potentials in the bovine Rieske iron-sulfur protein GM Ullmann, L Noodleman, DA Case JBIC Journal of Biological Inorganic Chemistry 7 (6), 632-639, 2002 | 147 | 2002 |
Photoswitching of the fluorescent protein asFP595: mechanism, proton pathways, and absorption spectra L Schäfer, G Groenhof, AR Klingen, GM Ullmann, M Boggio-Pasqua, ... Angewandte Chemie-International Edition 46 (4), 530-536, 2007 | 137 | 2007 |
Electron transfer between the quinones in the photosynthetic reaction center and its coupling to conformational changes B Rabenstein, GM Ullmann, EW Knapp Biochemistry 39 (34), 10487-10496, 2000 | 132 | 2000 |
Energetics of electron-transfer and protonation reactions of the quinones in the photosynthetic reaction center of Rhodopseudomonas viridis B Rabenstein, GM Ullmann, EW Knapp Biochemistry 37 (8), 2488-2495, 1998 | 129 | 1998 |
Relations between protonation constants and titration curves in polyprotic acids: a critical view GM Ullmann The Journal of Physical Chemistry B 107 (5), 1263-1271, 2003 | 126 | 2003 |
McVol-A program for calculating protein volumes and identifying cavities by a Monte Carlo algorithm MS Till, GM Ullmann Journal of molecular modeling 16, 419-429, 2010 | 124 | 2010 |
DNA-induced dimerization of poly (ADP-ribose) polymerase-1 triggers its activation E Pion, GM Ullmann, JC Amé, D Gérard, G de Murcia, E Bombarda Biochemistry 44 (44), 14670-14681, 2005 | 124 | 2005 |
The α helix dipole: screened out? D Sengupta, RN Behera, JC Smith, GM Ullmann Structure 13 (6), 849-855, 2005 | 120 | 2005 |
Calculation of protonation patterns in proteins with structural relaxation and molecular ensembles–application to the photosynthetic reaction center B Rabenstein, GM Ullmann, EW Knapp European biophysics journal 27, 626-637, 1998 | 97 | 1998 |
New regioselectivity in the cleavage of histidine-containing peptides by palladium (II) complexes studied by kinetic experiments and molecular dynamics simulations TN Parac, GM Ullmann, NM Kostić Journal of the American Chemical Society 121 (13), 3127-3135, 1999 | 92 | 1999 |
pH-Dependent pKa Values in Proteins - A Theoretical Analysis of Protonation Energies with Practical Consequences for Enzymatic Reactions E Bombarda, GM Ullmann The Journal of Physical Chemistry B 114 (5), 1994-2003, 2010 | 78 | 2010 |
Comparison of the physiologically equivalent proteins cytochrome c 6 and plastocyanin on the basis of their electrostatic potentials. Tryptophan 63 in cytochrome c 6 may be … GM Ullmann, M Hauswald, A Jensen, NM Kostić, EW Knapp Biochemistry 36 (51), 16187-16196, 1997 | 72 | 1997 |