Pound-wise but penny-foolish: How well do micromolecules fare in macromolecular refinement?
about
X-ray crystallography: Assessment and validation of protein-small molecule complexes for drug discovery.A new generation of crystallographic validation tools for the protein data bankXModeScore: a novel method for accurate protonation/tautomer-state determination using quantum-mechanically driven macromolecular X-ray crystallographic refinement.Structural Basis for Different Specificities of Acyltransferases Associated with the Human Cytosolic and Mitochondrial Fatty Acid SynthasesKinetic, thermodynamic and X-ray structural insights into the interaction of melatonin and analogues with quinone reductase 2Anchored plasticity opens doors for selective inhibitor design in nitric oxide synthaseThe Structural Basis for Recognition of the PreQ0 Metabolite by an Unusually Small Riboswitch Aptamer DomainStructural Characterisation of Ligand-Binding Determinants in Human Lung Surfactant Protein D: Influence of Asp325Structure of the HIV-1 Frameshift Site RNA Bound to a Small Molecule Inhibitor of Viral ReplicationA Novel Role for Coenzyme A during Hydride Transfer in 3-Hydroxy-3-methylglutaryl-coenzyme A ReductaseCrystal Structure of the Tetrameric Fibrinogen-like Recognition Domain of Fibrinogen C Domain Containing 1 (FIBCD1) ProteinAutomated macromolecular model building for X-ray crystallography using ARP/wARP version 7ACPYPE - AnteChamber PYthon Parser interfacEImproved ligand geometries in crystallographic refinement using AFITT in PHENIXelectronic Ligand Builder and Optimization Workbench (eLBOW): a tool for ligand coordinate and restraint generationPrincipal component analysis of chemical shift perturbation data of a multiple-ligand-binding system for elucidation of respective binding mechanism.Characterization and calculation of a cytochrome c-cytochrome b5 complex using NMR data.On vital aid: the why, what and how of validation.MotiveValidator: interactive web-based validation of ligand and residue structure in biomolecular complexes.Computational analysis of missense mutations causing Snyder-Robinson syndromeFragment-based screening by protein crystallography: successes and pitfalls.Crystal Structure of a Complex of Surfactant Protein D (SP-D) and Haemophilus influenzae Lipopolysaccharide Reveals Shielding of Core Structures in SP-D-Resistant Strains.NMR-assisted computational studies of peptidomimetic inhibitors bound in the hydrophobic pocket of HIV-1 glycoprotein 41.Rationally designed small compounds inhibit pilus biogenesis in uropathogenic bacteria.Oncogenic and RASopathy-associated K-RAS mutations relieve membrane-dependent occlusion of the effector-binding site.Productive versus unproductive nucleotide binding in yeast guanylate kinase mutants: comparison of R41M with K14M by proton two dimensional transferred NOESY.Keep it together: restraints in crystallographic refinement of macromolecule-ligand complexes.QM/MM refinement and analysis of protein bound retinoic acid.Investigating the structure of the factor B vWF-A domain/CD55 protein-protein complex using DEER spectroscopy: successes and pitfalls.Crystallographic refinement of ligand complexes.Structural and mechanistic insights into lunatic fringe from a kinetic analysis of enzyme mutants.The crystal structure of PfFabZ, the unique beta-hydroxyacyl-ACP dehydratase involved in fatty acid biosynthesis of Plasmodium falciparum.Biophysical and enzymatic properties of aminoglycoside adenylyltransferase AadA6 from Pseudomonas aeruginosa.Monomer-dimer control and crystal engineering in TASPs.Validation of ligands in macromolecular structures determined by X-ray crystallography.
P2860
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P2860
Pound-wise but penny-foolish: How well do micromolecules fare in macromolecular refinement?
description
2003 nî lūn-bûn
@nan
2003 թուականի Սեպտեմբերին հրատարակուած գիտական յօդուած
@hyw
2003 թվականի սեպտեմբերին հրատարակված գիտական հոդված
@hy
2003年の論文
@ja
2003年論文
@yue
2003年論文
@zh-hant
2003年論文
@zh-hk
2003年論文
@zh-mo
2003年論文
@zh-tw
2003年论文
@wuu
name
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@ast
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@en
type
label
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@ast
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@en
prefLabel
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@ast
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@en
P1433
P1476
Pound-wise but penny-foolish: ...... in macromolecular refinement?
@en
P2093
Daan M F van Aalten
Eleanor J Dodson
P304
P356
10.1016/S0969-2126(03)00186-2
P577
2003-09-01T00:00:00Z