LAFIRE: software for automating the refinement process of protein-structure analysis
M Yao, Y Zhou, I Tanaka - Acta Crystallographica Section D …, 2006 - journals.iucr.org
Manual intervention is usually required in the multiple rounds of refinement of protein crystal
structures, including linking and/or extending the fragments of the initial model and …
structures, including linking and/or extending the fragments of the initial model and …
Efficient rebuilding of protein structures
GJ Kleywegt, TA Jones - Acta Crystallographica Section D …, 1996 - journals.iucr.org
A computer program, called OOPS, is described which facilitates and speeds up the process
of rebuilding a protein structure inside its electron density and reduces the chances of local …
of rebuilding a protein structure inside its electron density and reduces the chances of local …
Simultaneous refinement of inaccurate local regions and overall structure in the CASP12 protein model refinement experiment
Advances in protein model refinement techniques are required as diverse sources of protein
structure information are available from low‐resolution experiments or informatics‐based …
structure information are available from low‐resolution experiments or informatics‐based …
Protein crystallography for aspiring crystallographers or how to avoid pitfalls and traps in macromolecular structure determination
A Wlodawer, W Minor, Z Dauter… - The FEBS journal, 2013 - Wiley Online Library
The number of macromolecular structures deposited in the Protein Data Bank now
approaches 100 000, with the vast majority of them determined by crystallographic methods …
approaches 100 000, with the vast majority of them determined by crystallographic methods …
Use of non-crystallographic symmetry in protein structure refinement
GJ Kleywegt - Acta Crystallographica Section D: Biological …, 1996 - journals.iucr.org
Several methods to assess the (dis) similarity of protein structures objectively are described,
some of which, when applied to non-crystallographically related protein models, are able to …
some of which, when applied to non-crystallographically related protein models, are able to …
[PDF][PDF] Fragon: rapid high-resolution structure determination from ideal protein fragments
HT Jenkins - Acta Crystallographica Section D: Structural Biology, 2018 - journals.iucr.org
Correctly positioning ideal protein fragments by molecular replacement presents an
attractive method for obtaining preliminary phases when no template structure for molecular …
attractive method for obtaining preliminary phases when no template structure for molecular …
EDPDB: a multifunctional tool for protein structure analysis
XJ Zhang, BW Matthews - Journal of applied crystallography, 1995 - journals.iucr.org
EDPDB is a Fortran program that simplifies the analysis of protein structure and makes it
easy to extract various types of geometrical and biologically relevant information for the …
easy to extract various types of geometrical and biologically relevant information for the …
Reliable quality-control methods for protein crystal structures
J Badger, J Hendle - Acta Crystallographica Section D: Biological …, 2002 - journals.iucr.org
The emergence of structure-determination initiatives that employ high-throughput protein
crystallography emphasizes the need to establish quality-control methods for screening the …
crystallography emphasizes the need to establish quality-control methods for screening the …
Protein crystallography for non‐crystallographers, or how to get the best (but not more) from published macromolecular structures
A Wlodawer, W Minor, Z Dauter… - The FEBS journal, 2008 - Wiley Online Library
The number of macromolecular structures deposited in the Protein Data Bank now exceeds
45 000, with the vast majority determined using crystallographic methods. Thousands of …
45 000, with the vast majority determined using crystallographic methods. Thousands of …
AutoDep: a web-based system for deposition and validation of macromolecular structural information
This paper describes the design and full implementation of a new concept in data deposition
and validation: AutoDep (copyright Brookhaven Science Associates LLC). AutoDep changes …
and validation: AutoDep (copyright Brookhaven Science Associates LLC). AutoDep changes …