| scholarly article | Q13442814 |
| P356 | DOI | 10.1007/S10858-006-9003-3 |
| P698 | PubMed publication ID | 16791739 |
| P50 | author | Jan H. Jensen | Q41894349 |
| P2093 | author name string | N Powers | |
| P2860 | cites work | Three‐dimensional solution structure of β cryptogein, a β elicitin secreted by a phytopathogenic fungus phytophthora cryptogea | Q24673606 |
| The highly refined solution structure of the cytotoxic ribonuclease alpha-sarcin reveals the structural requirements for substrate recognition and ribonucleolytic activity | Q27622788 | ||
| NMR structure of ribonuclease HI from Escherichia coli | Q27627528 | ||
| A refined solution structure of hen lysozyme determined using residual dipolar coupling data | Q27630831 | ||
| Structural details of ribonuclease H from Escherichia coli as refined to an atomic resolution | Q27642055 | ||
| Nuclear magnetic resonance solution structure of hirudin(1-51) and comparison with corresponding three-dimensional structures determined using the complete 65-residue hirudin polypeptide chain | Q27642095 | ||
| Three-dimensional solution structure of an insulin dimer. A study of the B9(Asp) mutant of human insulin using nuclear magnetic resonance, distance geometry and restrained molecular dynamics | Q27642160 | ||
| Solution structure of murine epidermal growth factor determined by NMR spectroscopy and refined by energy minimization with restraints | Q27643888 | ||
| Determination of the three-dimensional solution structure of barnase using nuclear magnetic resonance spectroscopy | Q27652512 | ||
| Structure of ubiquitin refined at 1.8 A resolution | Q27728512 | ||
| X-ray crystal structure of the complex of human leukocyte elastase (PMN elastase) and the third domain of the turkey ovomucoid inhibitor | Q27728655 | ||
| Solution conformation of proteinase inhibitor IIA from bull seminal plasma by 1H nuclear magnetic resonance and distance geometry | Q27728958 | ||
| Determination of the solution structure of Apo calbindin D9k by NMR spectroscopy | Q27730275 | ||
| The high-resolution three-dimensional solution structures of the oxidized and reduced states of human thioredoxin | Q27730698 | ||
| Solution structure of turkey ovomucoid third domain as determined from nuclear magnetic resonance data | Q27730922 | ||
| Solution structure of cardiotoxin V from Naja naja atra | Q27731975 | ||
| High-resolution three-dimensional structure of ribonuclease A in solution by nuclear magnetic resonance spectroscopy | Q27732016 | ||
| High-resolution structure of calcium-loaded calbindin D9k | Q27732182 | ||
| Crystal structures of reduced, oxidized, and mutated human thioredoxins: evidence for a regulatory homodimer | Q27733385 | ||
| Ionic interactions in crystalline bovine pancreatic ribonuclease A | Q27734234 | ||
| Crystal structure of a fungal elicitor secreted by Phytophthora cryptogea, a member of a novel class of plant necrotic proteins | Q27734351 | ||
| Crystal structure of cardiotoxin V from Taiwan cobra venom: pH-dependent conformational change and a novel membrane-binding motif identified in the three-finger loops of P-type cardiotoxin | Q27734902 | ||
| Solution Structure of the Transmembrane H+-Transporting Subunit c of the F1Fo ATP Synthase | Q27759156 | ||
| Role of water in plasticity, stability, and action of proteins: The crystal structures of lysozyme at very low levels of hydration | Q27765158 | ||
| SWISS‐MODEL and the Swiss‐Pdb Viewer: An environment for comparative protein modeling | Q27860614 | ||
| Refinement of protein structures in explicit solvent | Q27860639 | ||
| Errors in protein structures | Q27860776 | ||
| AQUA and PROCHECK-NMR: programs for checking the quality of protein structures solved by NMR | Q27860778 | ||
| The determinants of carboxyl pKa values in turkey ovomucoid third domain | Q44855339 | ||
| Effects of buried charged groups on cysteine thiol ionization and reactivity in Escherichia coli thioredoxin: structural and functional characterization of mutants of Asp 26 and Lys 57. | Q46069210 | ||
| Calculations of electrostatic interactions and pKas in the active site of Escherichia coli thioredoxin | Q46741558 | ||
| Validation of protein models derived from experiment | Q47624675 | ||
| Electrostatic interactions in the active site of the N-terminal thioredoxin-like domain of protein disulfide isomerase | Q47628555 | ||
| Validation of nuclear magnetic resonance structures of proteins and nucleic acids: hydrogen geometry and nomenclature | Q47903272 | ||
| Optimizing the hydrogen-bond network in Poisson-Boltzmann equation-based pK(a) calculations. | Q52064388 | ||
| Characterization of pKa values and titration shifts in the cytotoxic ribonuclease alpha-sarcin by NMR. Relationship between electrostatic interactions, structure, and catalytic function. | Q52230123 | ||
| Microscopic pKa values of Escherichia coli thioredoxin | Q52252586 | ||
| pH, ionic strength, and temperature dependences of ionization equilibria for the carboxyl groups in turkey ovomucoid third domain | Q52344514 | ||
| Structural details of Asp(B9) human insulin at low pH from two-dimensional NMR titration studies | Q52420506 | ||
| Proton-translocating carboxyl of subunit c of F1Fo H(+)-ATP synthase: the unique environment suggested by the pKa determined by 1H NMR. | Q54598437 | ||
| X-ray refinement of protein structures by simulated annealing: test of the method on myohemerythrin | Q57000548 | ||
| Measurement and modelling of sequence-specific pKa values of lysine residues in calbindin D9k | Q57136911 | ||
| Site-directed mutagenesis of bovine pancreatic ribonuclease: lysine-41 and aspartate-121 | Q67986192 | ||
| Characterization of pH titration shifts for all the nonlabile proton resonances a protein by two-dimensional NMR: the case of mouse epidermal growth factor | Q70161722 | ||
| The role of acidic amino acid residues in the structural stability of snake cardiotoxins | Q71248733 | ||
| Protein crystallization | Q71944092 | ||
| Transient hydrogen bonds identified on the surface of the NMR solution structure of Hirudin | Q72103048 | ||
| Amide proton titration shifts in bull seminal inhibitor IIA by two-dimensional correlated 1H nuclear magnetic resonance (COSY). Manifestation of conformational equilibria involving carboxylate groups | Q72402880 | ||
| The NMR solution structure and characterization of pH dependent chemical shifts of the beta-elicitin, cryptogein | Q77714223 | ||
| Role of protein-water hydrogen bond dynamics in the protein dynamical transition | Q77945289 | ||
| Improving the quality of protein structures derived by NMR spectroscopy | Q78049010 | ||
| Stability and dynamics of domain-swapped bovine-seminal ribonuclease | Q79455058 | ||
| X-ray structure of a monoclinic form of hen egg-white lysozyme crystallized at 313 K. Comparison of two independent molecules | Q80426293 | ||
| Assessing precision and accuracy of protein structures derived from NMR data | Q81635428 | ||
| MOLPROBITY: structure validation and all-atom contact analysis for nucleic acids and their complexes | Q27860865 | ||
| pKA values of carboxyl groups in the native and denatured states of barnase: the pKA values of the denatured state are on average 0.4 units lower than those of model compounds | Q28294636 | ||
| The ATP synthase--a splendid molecular machine | Q29617444 | ||
| Very fast empirical prediction and rationalization of protein pKa values | Q29619767 | ||
| Prediction of functionally important residues based solely on the computed energetics of protein structure. | Q30328695 | ||
| Empirical relationships between protein structure and carboxyl pKa values in proteins. | Q30331170 | ||
| Heterogeneity and inaccuracy in protein structures solved by X-ray crystallography. | Q30341462 | ||
| Proline cis-trans isomers in calbindin D9k observed by X-ray crystallography | Q30343296 | ||
| New Strategies for Protein Crystal Growth | Q31029157 | ||
| Mechanism of transmembrane signaling: insulin binding and the insulin receptor | Q33334997 | ||
| THEMATICS: a simple computational predictor of enzyme function from structure | Q33947797 | ||
| Role of the catalytic triad and oxyanion hole in acetylcholinesterase catalysis: an ab initio QM/MM study | Q33961036 | ||
| Protein NMR spectroscopy in structural genomics | Q34097120 | ||
| Measurement of the individual pKa values of acidic residues of hen and turkey lysozymes by two-dimensional 1H NMR. | Q34115171 | ||
| Combining conformational flexibility and continuum electrostatics for calculating pK(a)s in proteins | Q34178775 | ||
| Detergents as tools in membrane biochemistry | Q34296906 | ||
| New methods of structure refinement for macromolecular structure determination by NMR. | Q34469265 | ||
| Molecular dynamics applied to X-ray structure refinement | Q34524168 | ||
| ATP synthesis driven by proton transport in F1F0-ATP synthase | Q34534259 | ||
| Structural basis of perturbed pKa values of catalytic groups in enzyme active sites | Q34670783 | ||
| Mutation of conserved residues in Escherichia coli thioredoxin: Effects on stability and function | Q36277627 | ||
| Ribonuclease S-peptide as a carrier in fusion proteins. | Q36278000 | ||
| Structure of the subunit c oligomer in the F1Fo ATP synthase: model derived from solution structure of the monomer and cross-linking in the native enzyme | Q36405477 | ||
| On the evaluation and optimization of protein X-ray structures for pKa calculations | Q36559778 | ||
| Calculating pKa values in enzyme active sites | Q36572237 | ||
| Molecular structure of a new family of ribonucleases | Q36646102 | ||
| Individual ionization constants of all the carboxyl groups in ribonuclease HI from Escherichia coli determined by NMR. | Q36721675 | ||
| Ionization equilibria for side-chain carboxyl groups in oxidized and reduced human thioredoxin and in the complex with its target peptide from the transcription factor NF kappa B. | Q36790414 | ||
| The mechanism of detergent solubilization of liposomes and protein-containing membranes | Q40133636 | ||
| New applications of simulated annealing in X-ray crystallography and solution NMR. | Q41398215 | ||
| Determining the structures of large proteins and protein complexes by NMR. | Q41704452 | ||
| Electrostatic interactions in ubiquitin: stabilization of carboxylates by lysine amino groups. | Q44022493 | ||
| Quantitative evaluation of experimental NMR restraints. | Q44593564 | ||
| P433 | issue | 1 | |
| P304 | page(s) | 39-51 | |
| P577 | publication date | 2006-05-01 | |
| P1433 | published in | Journal of Biomolecular NMR | Q3186900 |
| P1476 | title | Chemically accurate protein structures: validation of protein NMR structures by comparison of measured and predicted pKa values | |
| P478 | volume | 35 |
| Q47402178 | Generation of specific inhibitors of SUMO-1- and SUMO-2/3-mediated protein-protein interactions using Affimer (Adhiron) technology |
| Q36088442 | H++ 3.0: automating pK prediction and the preparation of biomolecular structures for atomistic molecular modeling and simulations |
| Q50156659 | In Silico Evaluation of Variable pH on the Binding of Epidermal Growth Factor Receptor Ectodomain to its Ligand Through Molecular Dynamics Simulation in Tumors |
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