-
Notifications
You must be signed in to change notification settings - Fork 0
/
NATIVE.xinfo
41 lines (31 loc) · 1.1 KB
/
NATIVE.xinfo
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
! project crystal information - these will end up in the mtz file
! so keep it punchy! note well - these need to be closed off at the
! end of the input file...
BEGIN PROJECT PROJECT_NAME
BEGIN CRYSTAL CRYSTAL_NAME
BEGIN AA_SEQUENCE
! copy in one-letter AA sequence here - if you have it, since this will
! enable the solvent estimation stuff
END AA_SEQUENCE
! wavelength information - the wavelengths need to correspond to the
! header values to about 0.0001A.
BEGIN WAVELENGTH NATIVE
WAVELENGTH
END WAVELENGTH NATIVE
! sweep information - these are where the images you collected are mapped
! on to wavelengths to which they should belong... note that the wavelength
! here is a NAME corresponding to one of the wavelengths defined above...
! this example has a low and high resolution pass contributing to the
! NATIVE data set (WAVELENGTH NATIVE)
BEGIN SWEEP NATIVE_HR
WAVELENGTH NATIVE
IMAGE donut_1_001.img
DIRECTORY /path/to/images
END SWEEP NATIVE_HR
BEGIN SWEEP NATIVE_LR
WAVELENGTH NATIVE
IMAGE donut_2_001.img
DIRECTORY /path/to/images
END SWEEP NATIVE_LR
END CRYSTAL CRYSTAL_NAME
END PROJECT PROJECT_NAME