Dear Ronan
Thank you!
Happy holidays!
Jie
----- Original Message -----
From: "Ronan Keegan" <[log in to unmask]>
To: <[log in to unmask]>
Sent: Monday, December 16, 2013 3:40 AM
Subject: Re: [ccp4bb] MrBUMP not running after update
> Dear Jie,
>
> Thanks for spotting this problem. I've made a fix for MrBUMP that should
> address the problem. It will be included in the next CCP4 update which
> will go out tomorrow (Tuesday 17th of December) all being well.
>
> Best wishes,
>
> Ronan
>
>
> On 10/12/13 01:34, jie liu wrote:
>> Dear All
>>
>> I just installed CCP4-6.4 and all the subsequent updates. Now MrBump
>> failed
>> with the following error message:
>>
>> The program run with command: /usr/local/ccp4-6.4.0/bin/ccp4-python -u
>> /usr/local/ccp4-6.4.0/bin/mrbump HKLIN
>> /home/jie/Structures/local/se-p26c8newn6/ccp4_6.3/high_x4c.mtz SEQIN
>> /home/jie/Structures/local/se-p26c8newn6/ccp4_6.3/seq.seq HKLOUT
>> /home/jie/Structures/local/se-p26c8newn6/ccp4_6.3/high_x4c_mrbump_soln1.mtz
>> XYZOUT
>> /home/jie/Structures/local/se-p26c8newn6/ccp4_6.3/high_x4c_mrbump_soln1.pdb
>> has failed with error message
>> Traceback (most recent call last):
>> File "/usr/local/ccp4-6.4.0/bin/mrbump", line 107, in <module>
>> queue = master.fast_search_MR(init, target_info, mstat)
>> File
>> "/usr/local/ccp4-6.4.0/share/mrbump/include/initialisation/MRBUMP_master.py",
>> line 482, in fast_search_MR
>> ps.get_top_hit(mstat.sorted_MR_list, init, mstat)
>> File "/usr/local/ccp4-6.4.0/share/mrbump/include/structures/Matches.py",
>> line 1431, in get_top_hit
>> CHAIN=mstat.chain_list[chain]
>> KeyError: '1e6j_p2'
>>
>> It was running fine with CCP4-6.3. Could someone help please?
>>
>> Thanks!
>>
>> Jie
>>
>>
>
> --
> Scanned by iCritical.
>
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