Structure Determination of Proteins by Shake-and-Bake

10/29/97


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Table of Contents

  1. Title Slide

  2. Outline of Talk

  3. The Drug Design Process

  4. X-Ray Crystallography

  5. Photograph of Crystal

  6. A Crystal Structure

  7. Diffractometer

  8. The Diffraction Pattern

  9. X-Ray Data & Molecular Structure

  10. Why Direct Phasing Methods?

  11. Data Structures

  12. Direct Methods

  13. Phase Refinement

  14. Conventional Direct Methods

  15. Comparing Conventional Direct Methods with Shake-and-Bake

  16. Phasing and Structure Size

  17. Animation - 1

  18. Animation - 2

  19. Animation - 3

  20. Animation - 4

  21. Animation - 5

  22. Animation - 6

  23. Animation - 7

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  27. Animation - 11

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  31. Animation - 15

  32. Animation - 16

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  35. Animation - 19

  36. Animation - 20

  37. Animation - 21

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  40. Animation - 24

  41. Animation - 25

  42. Animation - 26

  43. Animation - 27

  44. Animation - 28

  45. Animation - 29

  46. Animation - 30

  47. Animation - 31

  48. Movie - 1

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  64. Movie - 17

  65. Movie - 18

  66. Movie - 19

  67. Movie - 20

  68. Movie - 21

  69. Movie - 22

  70. Movie - 23

  71. Structure of SnB

  72. SnB Parameters

  73. Ph8755: SnB Histogram

  74. PH8755: Trace of SnB Solution

  75. ToxII: SnB Histogram

  76. Tox II: Trace of SnB Solution

  77. ToxII: Quality of Solution

  78. ToxII: Quality of Solution: Another View

  79. Some Successful Protein Applications

  80. Vancomycin

  81. Vancomycin Crystal

  82. Vancomycin Crystal Structure Views

  83. Se-Met Problems

  84. Se-Met Example

  85. SnB 2.0: Rationale

  86. SnB Web Site

  87. SnB v2.0 Interface

  88. VRML Visualization

  89. SnB 2.0: Timings

  90. Computing Platforms(SnB v1.5)

  91. Current Research

  92. Conclusion

  93. Addresses

Author: Russ Miller

Email: miller@cs.buffalo.edu

Home Page: http://www.cs.buffalo.edu/pub/WWW/faculty/miller/