Re: [ccp4bb]: COORDCONV in CCP4-4.1

["Eleanor J. Dodson" <ccp4@ysbl.york.ac.uk>]

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Qian Xu wrote:
> 
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> 
> Hi, there,
> 
> I am trying to run COORDCONV in CCP4-4.1 to convert the coordinates
> of heavy atom sites from HA format to PDB format. The problem is that I
> couldn't get any coordinates except CRYST1 and SCALEx cards, although the
> program was done with "normal termination".
> 


It works for me?

CRYST1   50.190  131.600   59.320  90.00 109.69  90.00            
SCALE1      0.019924  0.000000  0.007130        0.00000
SCALE2      0.000000  0.007599  0.000000        0.00000
SCALE3      0.000000  0.000000  0.017905        0.00000
ATOM      1  HG  UNK     1       2.391  69.222   7.205  0.64
89.82              
ATOM      2  HG  UNK     2      22.259 122.520   9.048  0.62
92.03              
ATOM      3  HG  UNK     3       3.419  71.854   3.630  0.41
80.82              
ATOM      4  HG  UNK     4      21.430 119.756   5.753 
0.44108.64              
END                                                                             


 Eleanor

 ### CCP PROGRAM SUITE: COORDCONV        VERSION 4.1: 04/01/00##


 

 There doesnt seem to be any differences between the Daresbury release
and our code.

What machine are you working on?D
-- 
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Eleanor J.Dodson, Chemistry Department, University of York, U.K.
Tel: Home +44 (1904) 42 44 49, work:  +44 (1904) 43 25 65
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