Recent developments for the efficient crystallographic refinement of macromolecular structures

被引：79

作者：

Brünger, AT ^{[1
]}

Adams, PD

Rice, LM

机构：

[1] Yale Univ, Howard Hughes Med Inst, New Haven, CT 06511 USA

[2] Yale Univ, Dept Mol Biophys & Biochem, New Haven, CT 06511 USA

来源：

CURRENT OPINION IN STRUCTURAL BIOLOGY | 1998年 / 8卷 / 05期

基金：

美国国家科学基金会;

关键词：

D O I：

10.1016/S0959-440X(98)80152-8

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

Macromolecular crystallographic refinement has recently been made more efficient by the use of cross-validated maximum likelihood targets and torsion-angle molecular dynamics simulated annealing, In combination with automated model building methods, the amount of manual intervention required to complete and refine a structure is greatly reduced.

引用

页码：606 / 611

页数：6

共 38 条

[31]

PRESS WH, 1986, NUMERICAL RECIPES, P498

[32] Model phases: Probabilities and bias [J].

Read, RJ .

MACROMOLECULAR CRYSTALLOGRAPHY, PT B, 1997, 277 :110-128

[33] STRUCTURE-FACTOR PROBABILITIES FOR RELATED STRUCTURES [J].

READ, RJ .

ACTA CRYSTALLOGRAPHICA SECTION A, 1990, 46 :900-912

[34] TORSION ANGLE DYNAMICS - REDUCED VARIABLE CONFORMATIONAL SAMPLING ENHANCES CRYSTALLOGRAPHIC STRUCTURE REFINEMENT [J].

RICE, LM ;

BRUNGER, AT .

PROTEINS-STRUCTURE FUNCTION AND GENETICS, 1994, 19 (04) :277-290

[35]

RICE LM, 1998, IN PRESS J APPL CRYS

[36] DETECTION OF SUB-UNITS WITHIN CRYSTALLOGRAPHIC ASYMMETRIC UNIT [J].

ROSSMANN, MG ;

BLOW, DM .

ACTA CRYSTALLOGRAPHICA, 1962, 15 (JAN10) :24-&

[37] THE REFINEMENT OF SOUTHERN BEAN MOSAIC-VIRUS IN RECIPROCAL SPACE [J].

SILVA, AM ;

ROSSMANN, MG .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1985, 41 (APR) :147-157

[38] STRUCTURE AND REFINEMENT AT 1.8-A RESOLUTION OF THE ASPARTIC PROTEINASE FROM RHIZOPUS-CHINENSIS [J].

SUGUNA, K ;

BOTT, RR ;

PADLAN, EA ;

SUBRAMANIAN, E ;

SHERIFF, S ;

COHEN, GH ;

DAVIES, DR .

JOURNAL OF MOLECULAR BIOLOGY, 1987, 196 (04) :877-900

← 1 2 3 4 →