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Prime User Manual - ISP

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!UNUSABLE: SEQRES numbering is wrong<br />

Appendix D: Error Messages and Warnings<br />

• The number of residues in a particular chain does not agree with the number of residues<br />

shown in columns 14 to 17 of SEQRES.<br />

D.3 Edit Alignment<br />

Check Alignment<br />

When you click Next at the end of the Edit Alignment step, the Check Alignment warning may<br />

appear. The warning lists possible alignment problems that you may want to fix before<br />

continuing to the next step. For example, there may be gaps in secondary structure elements of<br />

the template, or gaps in the query that are aligned to secondary structure elements of the<br />

template.<br />

If you do not want to make corrections to the alignment, click Continue to go to the next step.<br />

To make corrections based on the information in the error message, make a note of the gap<br />

locations given, click Cancel to close the message box while remaining in Edit Alignment, and<br />

change the alignment accordingly.<br />

D.4 Build Structure<br />

Error messages and warnings for this generally appear in the log of a running job. The log can<br />

be viewed in the job Monitor panel until the job is completed.<br />

D.5 Refinement<br />

Error messages for Refinement generally appear in the log of a running job. The following is<br />

an example of a warning in the log of a loop refinement.<br />

Invalid Features<br />

When a loop refinement begins, a validation program checks the loop features of the structure.<br />

Apparent errors are reported in a warning dialog box. You may choose to Run All Features,<br />

Run Only Valid Features, orCancel. It is recommended that you make a note of the invalid<br />

features, click Cancel, and correct the structure if appropriate.<br />

<strong>Prime</strong> 2.1 <strong>User</strong> <strong>Manual</strong> 129

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