-
1
-
-
84943920736
-
Phase annealing in SHELX-90: Direct methods for larger structures
-
1. Sheldrick GM: Phase annealing in SHELX-90: direct methods for larger structures. Acta Crystallogr A 1990, 46:467-473.
-
(1990)
Acta Crystallogr A
, vol.46
, pp. 467-473
-
-
Sheldrick, G.M.1
-
2
-
-
0030781412
-
Charges, hydrogen bonds, and correlated motions in the 1Å resolution refined structure of the mating pheromone Er-1 from euplotes raikovi
-
2. Anderson DH, Weiss MS, Eisenberg D: Charges, hydrogen bonds, and correlated motions in the 1Å resolution refined structure of the mating pheromone Er-1 from Euplotes raikovi. J Mol Biol 1997, 273:479-500. An excellent description of the refinement strategy and final structural analysis of the mating pheromone Er-1 in view of the details that are revealed at atomic resolution. The authors analyze the hydrogen-bonding pattern, examine the charges and valancies, and subject their data to normal mode calculations in order to analyze the dynamical behavior.
-
(1997)
J Mol Biol
, vol.273
, pp. 479-500
-
-
Anderson, D.H.1
Weiss, M.S.2
Eisenberg, D.3
-
3
-
-
0031179495
-
A low energy short hydrogen bond in very high resolution structures of protein receptor-phosphate complexes
-
3. Wang Z, Luecke H, Yao N, Quiocho FA: A low energy short hydrogen bond in very high resolution structures of protein receptor-phosphate complexes. Nat Struct Biol 1997, 4:519-522. The atomic resolution of wildtype and T141D mutant protein receptor-phosphate complexes allowed an accurate determination of hydrogen-bond distances, as well as a very precise assessment of the positional errors. Accordingly, unambiguous evidence was obtained showing the existence of a very short (2.43 Å), low barrier hydrogen bond between the O4 atom of the bound phosphate and the OD2 atom of Asp56.
-
(1997)
Nat Struct Biol
, vol.4
, pp. 519-522
-
-
Wang, Z.1
Luecke, H.2
Yao, N.3
Quiocho, F.A.4
-
4
-
-
0031574909
-
Atomic resolution (1Å) crystal structure of Fusarium solani cutinase: Stereochemical analysis
-
4. Longhi S, Czjzek M, Lamzin V, Nicolas A, Cambillau C: Atomic resolution (1Å) crystal structure of Fusarium solani cutinase: stereochemical analysis. J Mol Biol 1997, 268:779-799.
-
(1997)
J Mol Biol
, vol.268
, pp. 779-799
-
-
Longhi, S.1
Czjzek, M.2
Lamzin, V.3
Nicolas, A.4
Cambillau, C.5
-
5
-
-
0032519982
-
Full-matrix least-squares refinement of lysozymes and analysis of anisotropic thermal motion
-
5. Harata K, Abe Y, Muraki M: Full-matrix least-squares refinement of lysozymes and analysis of anisotropic thermal motion. Proteins 1998, 30:232-243. The anisotropic refinement of atomic resolution data from two lysozymes has been analyzed by TLS (rigid body motion described as a linear function of three tensors: translation, t; libration, l; and screw motion, s) in order to examine the motion of the hinge domain. In this way, significant differences with classical refinements were found in the magnitude of thermal motion. The reported refinement of egg lysozyme structures indicates the importance of anisotropic temperature factors in improving the structural model. The main result of the motional analysis is that the hinge-bending motion is not as important as has been postulated in earlier work.
-
(1998)
Proteins
, vol.30
, pp. 232-243
-
-
Harata, K.1
Abe, Y.2
Muraki, M.3
-
6
-
-
4243772147
-
Insulin structure at 1.1 Angström resolution and its dynamic behavior with anisotropic temperature factors
-
6. Sakabe N, Sasaki K, Sakabe K: Insulin structure at 1.1 Angström resolution and its dynamic behavior with anisotropic temperature factors. Acta Crystallogr A 1981, 37:50-54.
-
(1981)
Acta Crystallogr A
, vol.37
, pp. 50-54
-
-
Sakabe, N.1
Sasaki, K.2
Sakabe, K.3
-
8
-
-
0030778007
-
The benefits of atomic resolution
-
8. Dauter Z, Lamzin VS, Wilson KS: The benefits of atomic resolution. Curr Opin Struct Biol 1997, 7:681-688. The authors extensively discuss the particular data collection, refinement and structure determination strategies and programs especially developed for this case. They emphasize the advantages of having high resolution X-ray structures and give a selection of recent atomic resolution structure determinations.
-
(1997)
Curr Opin Struct Biol
, vol.7
, pp. 681-688
-
-
Dauter, Z.1
Lamzin, V.S.2
Wilson, K.S.3
-
9
-
-
0039299578
-
Who checks the checkers? Four validation tools applied to eight atomic resolution structures
-
9. Wilson KS, Butterworth S, Dauter Z, Lamzin VS, Walsh M, Wodak S, Pontius J, Richelle J, Vaguine A, Sander C et al.: Who checks the checkers? Four validation tools applied to eight atomic resolution structures. J Mol Biol 1998, 276:417-436. Four validation programs were tested using eight structures determined at atomic resolution. The programs were tested with respect to error detection, to eventual changes in used mean values and to quality parameters. The structures were critically analyzed in the context of the target values of the parameters used as restraints in the refinement protocols. The authors also point out the importance of the precise determination of crystal cell parameters.
-
(1998)
J Mol Biol
, vol.276
, pp. 417-436
-
-
Wilson, K.S.1
Butterworth, S.2
Dauter, Z.3
Lamzin, V.S.4
Walsh, M.5
Wodak, S.6
Pontius, J.7
Richelle, J.8
Vaguine, A.9
Sander, C.10
-
10
-
-
0017411710
-
The protein data bank: A computer-based archival file for macromolecular structures
-
10. Bernstein FC, Koetzle TF, Williams GJB, Meyer EF Jr, Brice MD, Rodgers JR, Kennard O, Shimanouchi T, Tasumi M: The protein data bank: a computer-based archival file for macromolecular structures. J Mol Biol 1977, 112:535-542.
-
(1977)
J Mol Biol
, vol.112
, pp. 535-542
-
-
Bernstein, F.C.1
Koetzle, T.F.2
Williams, G.J.B.3
Meyer E.F., Jr.4
Brice, M.D.5
Rodgers, J.R.6
Kennard, O.7
Shimanouchi, T.8
Tasumi, M.9
-
11
-
-
0032080528
-
Domain motions in bacteriophage T4 lysozyme: A comparison between molecular dynamics and cristallographic data
-
11. deGroot BL, Hayward S, van Aalten DMF, Amadei A, Berendsen HJC: Domain motions in bacteriophage T4 lysozyme: a comparison between molecular dynamics and cristallographic data. Proteins 1998, 31:116-127.
-
(1998)
Proteins
, vol.31
, pp. 116-127
-
-
Groot, B.L.1
Hayward, S.2
Van Aalten, D.M.F.3
Amadei, A.4
Berendsen, H.J.C.5
-
12
-
-
0032535959
-
Accurate experimental electronic properties of DL-proline monohydrate obtained within 1 day
-
12. Koritsansky T, Flaig R, Zobel D, Krane HG, Morgenroth W, Luger P: Accurate experimental electronic properties of DL-proline monohydrate obtained within 1 day. Science 1998, 279:356-358.
-
(1998)
Science
, vol.279
, pp. 356-358
-
-
Koritsansky, T.1
Flaig, R.2
Zobel, D.3
Krane, H.G.4
Morgenroth, W.5
Luger, P.6
-
13
-
-
0032212106
-
Transferability of multipole charge density parameters: Application to very high resolution oligopeptide and protein structures
-
13. Jelsch C, Pichon-Pesme V, Lecomte C, Aubry A: Transferability of multipole charge density parameters: application to very high resolution oligopeptide and protein structures. Acta Crystallogr D 1998, 54:1306-1318. The authors describe the use of a database of charges and multipoles during the refinement of an octapeptide at 0.9 Å resolution in order to calculate and refine the charge density distribution. The results were analyzed in view of both the physical significance and the feasibility of this type of calculations.
-
(1998)
Acta Crystallogr D
, vol.54
, pp. 1306-1318
-
-
Jelsch, C.1
Pichon-Pesme, V.2
Lecomte, C.3
Aubry, A.4
-
14
-
-
0030052290
-
Role of hydration and water structure in biological and colloidal interactions
-
14. Israelachvili J, Wennerström H: Role of hydration and water structure in biological and colloidal interactions. Nature 1996, 379:219-225.
-
(1996)
Nature
, vol.379
, pp. 219-225
-
-
Israelachvili, J.1
Wennerström, H.2
-
15
-
-
0032478214
-
Protein hydration in solution: Experimental observation by X-ray and neutron scattering
-
2O solutions in order to examine the protein-solvent interface. The authors compared their results to those of previous experiments and concluded that the existence of a first hydration shell, with an average density about 10% larger than that of the bulk solvent, seems to be a general feature of proteins.
-
(1998)
Proc Natl Acad Sci USA
, vol.95
, pp. 2267-2272
-
-
Svergun, D.I.1
Richard, S.2
Koch, M.H.J.3
Sayers, Z.4
Kuprin, S.5
Zaccai, G.6
-
16
-
-
0000243829
-
PROCHECK: A program to check stereochemical quality of protein structures
-
16. Laskowski RA, MacArthur MW, Moss DS, Thronton JM: PROCHECK: a program to check stereochemical quality of protein structures. J Appl Crystallogr 1993, 26:283-291.
-
(1993)
J Appl Crystallogr
, vol.26
, pp. 283-291
-
-
Laskowski, R.A.1
MacArthur, M.W.2
Moss, D.S.3
Thronton, J.M.4
-
17
-
-
0027081912
-
SQUID: A program for the analysis and display of data from crystallography and molecular dynamics
-
17. Oldfield TJ: SQUID: a program for the analysis and display of data from crystallography and molecular dynamics. J Mol Graphics 1992, 10:247-252.
-
(1992)
J Mol Graphics
, vol.10
, pp. 247-252
-
-
Oldfield, T.J.1
-
18
-
-
0344186399
-
Errors in protein structures
-
18. Hooft RWW, Sander C, Vriend G, Abola EE: Errors in protein structures. Nature 1996, 381:272.
-
(1996)
Nature
, vol.381
, pp. 272
-
-
Hooft, R.W.W.1
Sander, C.2
Vriend, G.3
Abola, E.E.4
-
19
-
-
0030598343
-
Deviations from standard atomic volumes as a quality measure for protein crystal structures
-
19. Pontius J, Richelle J, Wodak S: Deviations from standard atomic volumes as a quality measure for protein crystal structures. J Mol Biol 1996, 264:121-136.
-
(1996)
J Mol Biol
, vol.264
, pp. 121-136
-
-
Pontius, J.1
Richelle, J.2
Wodak, S.3
-
20
-
-
79952608525
-
Accurate bond and angle parameters for X-ray protein structure refinement
-
20. Engh RA, Huber R: Accurate bond and angle parameters for X-ray protein structure refinement. Acta Crystallogr A 1991, 47:392-400.
-
(1991)
Acta Crystallogr A
, vol.47
, pp. 392-400
-
-
Engh, R.A.1
Huber, R.2
-
21
-
-
0027909076
-
On the application of the minimal principle to solve unknown structures
-
21. Miller R, DeTitta GT, Jones R, Langs DA, Weeks CM, Hauptman HA: On the application of the minimal principle to solve unknown structures. Science 1993, 259:1430-1433.
-
(1993)
Science
, vol.259
, pp. 1430-1433
-
-
Miller, R.1
DeTitta, G.T.2
Jones, R.3
Langs, D.A.4
Weeks, C.M.5
Hauptman, H.A.6
-
22
-
-
0028485498
-
SnB: Crystal structure determination via Shake-and-Bake
-
22. Miller R, Gallo SM, DeTitta GT, Khalak HG, Weeks CM: SnB: crystal structure determination via Shake-and-Bake. J Appl Crystallogr 1994, 27:613-621.
-
(1994)
J Appl Crystallogr
, vol.27
, pp. 613-621
-
-
Miller, R.1
Gallo, S.M.2
Detitta, G.T.3
Khalak, H.G.4
Weeks, C.M.5
-
24
-
-
0032077350
-
A ligand-mediated dimerization mode for vancomycin
-
24. Loll PJ, Miller R, Weeks CM, Axelsen PH: A ligand-mediated dimerization mode for vancomycin. Chem Biol 1998, 5:293-298. Using low temperature synchrotron X-ray data combined with 'Shake and Bake' ab initio techniques, the crystal structure of vancomycin complexed with N-acetyl-D-alanine was solved at 0.97 Å. A new dimeric form of vancomycin was observed as a face-to-face configuration of the monomers. A large portion of the dimer interface is occupied by the ligand.
-
(1998)
Chem Biol
, vol.5
, pp. 293-298
-
-
Loll, P.J.1
Miller, R.2
Weeks, C.M.3
Axelsen, P.H.4
-
25
-
-
0030885214
-
Ab initio structure determination and refinement of a scorpion protein toxin
-
25. Smith GD, Blessing RH, Ealick SE, Fontecilla-Camps JC, Hauptman HA, Housset D, Langs DA, Miller R: Ab initio structure determination and refinement of a scorpion protein toxin. Acta Crystallogr D 1997, 53:551-557. This paper provides an excellent and, at the same time, the largest (> 600 atoms) example of the successful use of the ab initio 'Shake and Bake' method.
-
(1997)
Acta Crystallogr D
, vol.53
, pp. 551-557
-
-
Smith, G.D.1
Blessing, R.H.2
Ealick, S.E.3
Fontecilla-Camps, J.C.4
Hauptman, H.A.5
Housset, D.6
Langs, D.A.7
Miller, R.8
-
26
-
-
0032031501
-
Structure of balhimycin and its complex with solvent molecules
-
26. Schäfer M, Sheldrick GM, Schneider TR, Vertesy L: Structure of balhimycin and its complex with solvent molecules. Acta Crystallogr D 1998, 54:175-183.
-
(1998)
Acta Crystallogr D
, vol.54
, pp. 175-183
-
-
Schäfer, M.1
Sheldrick, G.M.2
Schneider, T.R.3
Vertesy, L.4
-
27
-
-
0032128284
-
Refinement of triclinic hen egg-white lysozyme at atomic resolution
-
27. Walsh MA, Schneider TR, Sieker LC, Dauter Z, Lamzin VS, Wilson KS: Refinement of triclinic hen egg-white lysozyme at atomic resolution. Acta Crystallogr D 1998, 54:522-546. A very thorough analysis of a refinement at atomic resolution. The protocol of refinement at room temperature and 120K is described in every detail, as well as the resulting structural model. The model is also compared to that observed at lower resolution with respect to disorder, solvent molecules and ions.
-
(1998)
Acta Crystallogr D
, vol.54
, pp. 522-546
-
-
Walsh, M.A.1
Schneider, T.R.2
Sieker, L.C.3
Dauter, Z.4
Lamzin, V.S.5
Wilson, K.S.6
-
28
-
-
0030471364
-
The role of water in sequence-independent ligand binding by an oligopeptide transporter protein
-
28. Tame JRH, Sleigh SH, Wilkinson AJ, Ladbury JE: The role of water in sequence-independent ligand binding by an oligopeptide transporter protein. Nat Struct Biol 1996, 3:998-1001.
-
(1996)
Nat Struct Biol
, vol.3
, pp. 998-1001
-
-
Tame, J.R.H.1
Sleigh, S.H.2
Wilkinson, A.J.3
Ladbury, J.E.4
-
29
-
-
0030738859
-
Crystal structure at 1.2 Å resolution and active site mapping of Escherichia coli peptidyl-tRNA hydrolase
-
29. Schmitt E, Mechulam Y, Fromant M, Plateau P, Blanquet S: Crystal structure at 1.2 Å resolution and active site mapping of Escherichia coli peptidyl-tRNA hydrolase. EMBO J 1997, 16:4760-4769.
-
(1997)
EMBO J
, vol.16
, pp. 4760-4769
-
-
Schmitt, E.1
Mechulam, Y.2
Fromant, M.3
Plateau, P.4
Blanquet, S.5
-
30
-
-
0030570768
-
Interaction between left-handed Z-DNA and polyamine-2
-
30. Ohishi H, Nakanishi I, Inubushi K, van der Marel G, van Boom JH, Rich A, Wang AHJ, Hakoshima T, Tomita K: Interaction between left-handed Z-DNA and polyamine-2. FEBS Lett 1996, 391:153-156.
-
(1996)
FEBS Lett
, vol.391
, pp. 153-156
-
-
Ohishi, H.1
Nakanishi, I.2
Inubushi, K.3
Van Der Marel, G.4
Van Boom, J.H.5
Rich, A.6
Wang, A.H.J.7
Hakoshima, T.8
Tomita, K.9
-
31
-
-
0031576353
-
The crystal structure of a parallel-stranded guanine tetraplex at 0.95 Å resolution
-
31. Phillips K, Dauter Z, Murchie AIH, Lilley DMJ, Luisi B: The crystal structure of a parallel-stranded guanine tetraplex at 0.95 Å resolution. J Mol Biol 1997, 273:171-182.
-
(1997)
J Mol Biol
, vol.273
, pp. 171-182
-
-
Phillips, K.1
Dauter, Z.2
Murchie, A.I.H.3
Lilley, D.M.J.4
Luisi, B.5
-
32
-
-
12644293826
-
The bi-loop, a new general four-stranded DNA motif
-
32. Salisbury SA, Wilson SE, Powell HR, Kennard O, Lubini P, Sheldrick GM, Escaja N, Alazzouzi E, Grandas A, Pedroso E: The bi-loop, a new general four-stranded DNA motif. Proc Natl Acad Sci USA 1997, 94:5515-5518.
-
(1997)
Proc Natl Acad Sci USA
, vol.94
, pp. 5515-5518
-
-
Salisbury, S.A.1
Wilson, S.E.2
Powell, H.R.3
Kennard, O.4
Lubini, P.5
Sheldrick, G.M.6
Escaja, N.7
Alazzouzi, E.8
Grandas, A.9
Pedroso, E.10
-
33
-
-
0031861965
-
1.2 Å refinement of the Kunitz-type domain from the α3 chain of human type VI collagen
-
33. Merigeau K, Arnoux B, Perahia D, Norris K, Norris F, Arnaux D: 1.2 Å refinement of the Kunitz-type domain from the α3 chain of human type VI collagen. Acta Crystallogr D 1998, 54:306-312. Using synchrotron radiation, the resolution of the recombinant Kunitz-type domain (C5) from the human collagen α3 chain was extended from 1.6 Å to 1.2 Å. The improvement in the quality of the final electron density maps made it possible to locate the N and C termini, which were missing in the 1.6 Å structure.
-
(1998)
Acta Crystallogr D
, vol.54
, pp. 306-312
-
-
Merigeau, K.1
Arnoux, B.2
Perahia, D.3
Norris, K.4
Norris, F.5
Arnaux, D.6
-
34
-
-
0023120307
-
Structure of form III crystals of bovine pancreatic trypsin inhibitor
-
34. Wlodawer A: Structure of form III crystals of bovine pancreatic trypsin inhibitor. J Mol Biol 1987, 193:145-156.
-
(1987)
J Mol Biol
, vol.193
, pp. 145-156
-
-
Wlodawer, A.1
-
35
-
-
0002841934
-
Refinement of rubredoxin from Desulfovibrio vulgaris at 1.0 Å with and without restraints
-
35. Dauter Z, Sieker LC, Wilson KS: Refinement of rubredoxin from Desulfovibrio vulgaris at 1.0 Å with and without restraints. Acta Crystallogr B 1992, 48:42-59.
-
(1992)
Acta Crystallogr B
, vol.48
, pp. 42-59
-
-
Dauter, Z.1
Sieker, L.C.2
Wilson, K.S.3
-
36
-
-
0029787099
-
Zinc-and iron-rubredoxins from Clostridium pasteurianum at atomic resolution: A high-precision model of a zns4 coordination unit in a protein
-
36. Dauter Z, Wilson KS, Sieker LC, Moulis JM, Meyer J: Zinc-and iron-rubredoxins from Clostridium pasteurianum at atomic resolution: a high-precision model of a ZnS4 coordination unit in a protein. Proc Natl Acad Sci USA 1996, 93:8836-8840.
-
(1996)
Proc Natl Acad Sci USA
, vol.93
, pp. 8836-8840
-
-
Dauter, Z.1
Wilson, K.S.2
Sieker, L.C.3
Moulis, J.M.4
Meyer, J.5
-
37
-
-
0028033838
-
Refined crystal structure of the 2[4Fe-4S] ferredoxin from Clostridium acidurici at 1.84 Å resolution
-
37. Duée ED, Fanchon E, Vicat J, Sieker LC, Meyer J, Moulis JM: Refined crystal structure of the 2[4Fe-4S] ferredoxin from Clostridium acidurici at 1.84 Å resolution. J Mol Biol 1994, 243:683-695.
-
(1994)
J Mol Biol
, vol.243
, pp. 683-695
-
-
Duée, E.D.1
Fanchon, E.2
Vicat, J.3
Sieker, L.C.4
Meyer, J.5
Moulis, J.M.6
-
38
-
-
0031414753
-
Atomic resolution (0.94 Å) structure of Clostridium acidurici ferredoxin. Detailed geometry of [4Fe-4S] clusters in a protein
-
38. Dauter Z, Wilson KS, Sieker LC, Meyer J, Moulis JM: Atomic resolution (0.94 Å) structure of Clostridium acidurici ferredoxin. Detailed geometry of [4Fe-4S] clusters in a protein. Biochemistry 1997, 36:16065-16073. Using low temperature synchrotron X-ray data, the crystal structure of C. acidurici ferredoxin, a protein containing two iron-sulfur clusters, was refined at 0.94 Å. The first precise determination of the geometry of the [4Fe-4S] clusters, as well as the analysis of the structural constraints imposed on these metal centers by the polypeptide chain, are reported.
-
(1997)
Biochemistry
, vol.36
, pp. 16065-16073
-
-
Dauter, Z.1
Wilson, K.S.2
Sieker, L.C.3
Meyer, J.4
Moulis, J.M.5
-
39
-
-
0001245801
-
Influence of a phase transition in the solid state on the structure of a synthetic iron-sulfur cubane
-
39. Excoffon P, Laugier J, Lamotte B: Influence of a phase transition in the solid state on the structure of a synthetic iron-sulfur cubane. Inorg Chem 1991, 30:3075-3081.
-
(1991)
Inorg Chem
, vol.30
, pp. 3075-3081
-
-
Excoffon, P.1
Laugier, J.2
Lamotte, B.3
-
40
-
-
0032522812
-
Ef-hands at atomic resolution: The structure of human psoriasin (S100A7) solved by MAD phasing
-
40. Brodersen DE, Etzerodt M, Madsen P, Celis JE, Thøgersen HC, Nyborg J, Kjeldgaard M: EF-hands at atomic resolution: the structure of human psoriasin (S100A7) solved by MAD phasing. Structure 1998, 6:477-489. The crystal structure of human psoriasin, a protein belonging to the EF-hand class of calcium-binding proteins, has been solved by multiple anomalous dispersion phasing with holmium and refined to atomic resolution. In contrast to earlier results from solution structures, the electron density in the crystal structure for the calcium-binding loops is extremely well defined and the loops exhibit very little thermal disorder.
-
(1998)
Structure
, vol.6
, pp. 477-489
-
-
Brodersen, D.E.1
Etzerodt, M.2
Madsen, P.3
Celis, J.E.4
Thøgersen, H.C.5
Nyborg, J.6
Kjeldgaard, M.7
-
41
-
-
0029125084
-
2+-binding proteins
-
2+-binding proteins. Nat Struct Biol 1995, 2:790-796.
-
(1995)
Nat Struct Biol
, vol.2
, pp. 790-796
-
-
Potts, B.C.M.1
Smith, J.2
Akke, M.3
Macke, T.J.4
Okazaki, K.5
Hidaka, H.6
Case, D.A.7
Chazin, W.J.8
-
42
-
-
0028133695
-
High-resolution structures of single-metal-substituted concanavalin A: The Co, Ca-protein at 1.6 Å and the Ni, Ca-protein at 2.0 Å
-
42. Emmerich C, Helliwell JR, Redshaw M, Naismith JH, Harrop SJ, Raftery J, Kalb AJ, Yariv J, Dauter Z, Wilson KS: High-resolution structures of single-metal-substituted concanavalin A: the Co, Ca-protein at 1.6 Å and the Ni, Ca-protein at 2.0 Å. Acta Crystallogr D 1994, 50:749-756.
-
(1994)
Acta Crystallogr D
, vol.50
, pp. 749-756
-
-
Emmerich, C.1
Helliwell, J.R.2
Redshaw, M.3
Naismith, J.H.4
Harrop, S.J.5
Raftery, J.6
Kalb, A.J.7
Yariv, J.8
Dauter, Z.9
Wilson, K.S.10
-
43
-
-
33751163048
-
The structure of concanavalin A and its bound solvent determined with small-molecule accuracy at 0.94 Å resolution
-
43. Deacon A, Gleichmann T, Kalb AJ, Price H, Raftery J, Bradbrook G, Yariv J, Helliwell JR: The structure of concanavalin A and its bound solvent determined with small-molecule accuracy at 0.94 Å resolution. J Chem Soc Faraday Trans 1997, 93:4305-4312. This paper is an excellent description of the structure of the lectin concanavalin A at 0.94 Å, which, to date, represents the largest protein refined at atomic resolution. The quality of the electron density maps allowed the authors to describe accurately the solvent network, as well as the ion-containing combining site. The authors could clearly distinguish between protonated carboxyl and carboxylate sidechains.
-
(1997)
J Chem Soc Faraday Trans
, vol.93
, pp. 4305-4312
-
-
Deacon, A.1
Gleichmann, T.2
Kalb, A.J.3
Price, H.4
Raftery, J.5
Bradbrook, G.6
Yariv, J.7
Helliwell, J.R.8
-
44
-
-
0016309240
-
Electron spin resonance spectroscopy of single crystals of concanavalin a
-
44. Meirovitch E, Luz Z, Kalb AJ: Electron spin resonance spectroscopy of single crystals of concanavalin A. J Am Chem Soc 1974, 96:7538-7542.
-
(1974)
J Am Chem Soc
, vol.96
, pp. 7538-7542
-
-
Meirovitch, E.1
Luz, Z.2
Kalb, A.J.3
-
46
-
-
0001841380
-
On the rigid-body motion of molecules in crystals
-
46. Schomaker V, Trueblood KN: On the rigid-body motion of molecules in crystals. Acta Crystallogr B 1968, 34:63-76.
-
(1968)
Acta Crystallogr B
, vol.34
, pp. 63-76
-
-
Schomaker, V.1
Trueblood, K.N.2
-
49
-
-
0032510475
-
Structure at 0.85 Å resolution of an early protein photocycle intermediate
-
49. Genick UK, Soltis SM, Kuhn P, Canestrelli IL, Getzoff ED: Structure at 0.85 Å resolution of an early protein photocycle intermediate. Nature 1998, 392:206-209. The authors describe the structural changes at ultrahigh resolution of a trapped excited state of a protein-bound chromophore. The chromophore isomerizes by flipping its thioester linkage with the protein. The results presented here provide a model for general phototransduction signaling.
-
(1998)
Nature
, vol.392
, pp. 206-209
-
-
Genick, U.K.1
Soltis, S.M.2
Kuhn, P.3
Canestrelli, I.L.4
Getzoff, E.D.5
-
50
-
-
0032578355
-
The 0.78 Å structure of a serine protease: Bacillus lentus subtilisin
-
50. Kuhn P, Knapp M, Soltis SM, Ganshaw G, Thoene M, Bott R: The 0.78 Å structure of a serine protease: Bacillus lentus subtilisin. Biochemistry 1998, 37:13446-13452. The ultrahigh resolution structure presented here provides an improved atomic model and new aspects of the generally accepted serine protease mechanism of action. Electron density showing an unusual, short hydrogen bond between aspartic acid and histidine in the catalytic triad sheds new light on the mechanism of action.
-
(1998)
Biochemistry
, vol.37
, pp. 13446-13452
-
-
Kuhn, P.1
Knapp, M.2
Soltis, S.M.3
Ganshaw, G.4
Thoene, M.5
Bott, R.6
|