                                 inforesidue



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Function

   Return information on a given amino acid residue

Description

   inforesidue reports the defined properties for all known residues, or
   for any residues specified by the user.

Usage

   Here is a sample session with inforesidue


% inforesidue
Return information on a given amino acid residue
Amino acid residue code [ABCDEFGHIJKLMNOPQRSTUVWXYZ]:
Output file [outfile.inforesidue]:


   Go to the output files for this example

Command line arguments

Return information on a given amino acid residue
Version: EMBOSS:6.6.0.0

   Standard (Mandatory) qualifiers:
  [-code]              string     [ABCDEFGHIJKLMNOPQRSTUVWXYZ] Enter IUPAC
                                  amino acids codes, e.g. A, C, D, E etc. (Any
                                  string)
  [-outfile]           outfile    [*.inforesidue] Output file name

   Additional (Optional) qualifiers: (none)
   Advanced (Unprompted) qualifiers:
   -aadata             datafile   [Eamino.dat] Amino acid properties
   -mwdata             datafile   [Emolwt.dat] Molecular weight data for amino
                                  acids

   Associated qualifiers:

   "-outfile" associated qualifiers
   -odirectory2        string     Output directory

   General qualifiers:
   -auto               boolean    Turn off prompts
   -stdout             boolean    Write first file to standard output
   -filter             boolean    Read first file from standard input, write
                                  first file to standard output
   -options            boolean    Prompt for standard and additional values
   -debug              boolean    Write debug output to program.dbg
   -verbose            boolean    Report some/full command line options
   -help               boolean    Report command line options and exit. More
                                  information on associated and general
                                  qualifiers can be found with -help -verbose
   -warning            boolean    Report warnings
   -error              boolean    Report errors
   -fatal              boolean    Report fatal errors
   -die                boolean    Report dying program messages
   -version            boolean    Report version number and exit


Input file format

   inforesidue uses a string of residue codes.

Output file format

   inforesidue outputs a text table of residue properties.

  Output files for usage example

  File: outfile.inforesidue

Code Short Mnemonic             Charge     MolWt Properties
Ambiguity
A    Ala   alanine                 0.0   71.0788 tiny,small,aliphatic,nonpolar
A
B    Asx   aspartate/asparagine   -0.5  114.5962 small
DN
C    Cys   cysteine                0.0  103.1388 tiny,small,nonpolar
C
D    Asp   aspartate              -1.0  115.0886 small,polar
D
E    Glu   glutamate              -1.0  129.1155 polar
E
F    Phe   phenylalanine           0.0  147.1766 aromatic,nonpolar
F
G    Gly   glycine                 0.0   57.0519 tiny,small,nonpolar
G
H    His   histidine              +0.5  137.1411 aromatic,polar
H
I    Ile   isoleucine              0.0  113.1594 aliphatic,nonpolar
I
J    ---   leucine/isoleucine      0.0  113.1594 aliphatic,nonpolar
IL
K    Lys   lysine                 +1.0  128.1741 polar
K
L    Leu   leucine                 0.0  113.1594 aliphatic,nonpolar
L
M    Met   methionine              0.0  131.1926 nonpolar
M
N    Asn   asparagine              0.0  114.1038 small,polar
N
O    ---   pyrrolysine            +1.0  237.3018 polar
O
P    Pro   proline                 0.0   97.1167 small,nonpolar
P
Q    Gln   glutamine               0.0  128.1307 polar
Q
R    Arg   arginine               +1.0  156.1875 polar
R
S    Ser   serine                  0.0   87.0782 tiny,small,polar
S
T    Thr   threonine               0.0  101.1051 tiny,small,polar
T
U    ---   selenocysteine          0.0  150.0388 tiny,small,nonpolar
U
V    Val   valine                  0.0   99.1326 small,aliphatic,nonpolar
V
W    Trp   tryptophan              0.0  186.2132 aromatic,nonpolar
W
X    Xaa   unknown                 0.0  118.8860 (none)
ACDEFGHIKLMNPQRSTVWY
Y    Tyr   tyrosine                0.0  163.1760 aromatic,nonpolar
Y
Z    Glx   glutamate/glutamine    -0.5  128.6231 polar
EQ

Data files

   inforesidue reads the Eresidues.iub file to define IUB standard codes
   for nucleotides and ambiguity codes, and files Eamino.dat and
   Emolwt.dat to read other amino acid residue chemical proerties and
   molecular weights.

   EMBOSS data files are distributed with the application and stored in
   the standard EMBOSS data directory, which is defined by the EMBOSS
   environment variable EMBOSS_DATA.

   To see the available EMBOSS data files, run:

% embossdata -showall

   To fetch one of the data files (for example 'Exxx.dat') into your
   current directory for you to inspect or modify, run:

% embossdata -fetch -file Exxx.dat


   Users can provide their own data files in their own directories.
   Project specific files can be put in the current directory, or for
   tidier directory listings in a subdirectory called ".embossdata". Files
   for all EMBOSS runs can be put in the user's home directory, or again
   in a subdirectory called ".embossdata".

   The directories are searched in the following order:
     * . (your current directory)
     * .embossdata (under your current directory)
     * ~/ (your home directory)
     * ~/.embossdata

Notes

   None.

References

   None.

Warnings

   None.

Diagnostic Error Messages

   None.

Exit status

   It always exits with status 0.

Known bugs

   None.

See also

                    Program name                  Description
                    infobase     Return information on a given nucleotide base

Author(s)

   Jon              Ison
   European         Bioinformatics Institute, Wellcome Trust Genome Campus,
   Hinxton,         Cambridge CB10 1SD, UK

                    Please report all bugs to the EMBOSS bug team
                    (emboss-bug (c) emboss.open-bio.org) not to the original author.

History

Target users

                    This program is intended to be used by everyone and everything, from
                    naive users to embedded scripts.

Comments

                    None
