PDB Code: SCR

X-PLOR files

Heterogen file generated from the file hetero.pdb



COMPND SCR SUCROSE OCTASULFATE
REMARK SCR Extracted from PDB file 1afc.pdb
REMARK SCR Formula C12 H22 O35 S8 --------
REMARK SCR Nr of non-hydrogen atoms 55
REMARK SCR Residue type SCR
REMARK SCR Residue name 969
REMARK SCR Original residue name (for O) $A141
REMARK   2 RESOLUTION. 2.7  ANGSTROMS.                                  1AFC  23 SCR
HETATM    1  C1  SCR   969       2.048   1.005  -0.270  1.00 20.00      1AFC
HETATM    2  C2  SCR   969       1.742   2.228   0.560  1.00 20.00      1AFC
HETATM    3  C3  SCR   969       0.290   2.030   0.924  1.00 20.00      1AFC
HETATM    4  C4  SCR   969      -0.549   1.997  -0.369  1.00 20.00      1AFC
HETATM    5  C5  SCR   969       0.043   1.053  -1.443  1.00 20.00      1AFC
HETATM    6  C6  SCR   969      -0.445   1.075  -2.891  1.00 20.00      1AFC
HETATM    7  C11 SCR   969       2.880  -2.017   1.171  1.00 20.00      1AFC
HETATM    8  C12 SCR   969       1.912  -1.509   0.068  1.00 20.00      1AFC
HETATM    9  C13 SCR   969       0.767  -2.484  -0.057  1.00 20.00      1AFC
HETATM   10  C14 SCR   969       0.632  -2.834  -1.505  1.00 20.00      1AFC
HETATM   11  C15 SCR   969       1.723  -2.135  -2.256  1.00 20.00      1AFC
HETATM   12  C16 SCR   969       1.117  -0.987  -3.092  1.00 20.00      1AFC
HETATM   13  O1  SCR   969       1.467  -0.163   0.353  1.00 20.00      1AFC
HETATM   14  O2  SCR   969       2.651   2.290   1.714  1.00 20.00      1AFC
HETATM   15  O22 SCR   969       3.382   3.266   3.762  1.00 20.00      1AFC
HETATM   16  O23 SCR   969       2.014   4.570   2.281  1.00 20.00      1AFC
HETATM   17  O24 SCR   969       4.248   4.123   1.725  1.00 20.00      1AFC
HETATM   18  O3  SCR   969      -0.168   3.071   1.826  1.00 20.00      1AFC
HETATM   19  O32 SCR   969       0.576   1.939   3.882  1.00 20.00      1AFC
HETATM   20  O33 SCR   969      -0.238   4.179   3.933  1.00 20.00      1AFC
HETATM   21  O34 SCR   969      -1.689   2.320   3.542  1.00 20.00      1AFC
HETATM   22  O4  SCR   969      -1.762   1.392   0.102  1.00 20.00      1AFC
HETATM   23  O42 SCR   969      -3.970   1.972  -0.192  1.00 20.00      1AFC
HETATM   24  O43 SCR   969      -2.391   3.577   0.308  1.00 20.00      1AFC
HETATM   25  O44 SCR   969      -3.133   2.042   1.974  1.00 20.00      1AFC
HETATM   26  O5  SCR   969       1.438   1.234  -1.528  1.00 20.00      1AFC
HETATM   27  O6  SCR   969      -1.645   1.822  -3.105  1.00 20.00      1AFC
HETATM   28  O62 SCR   969      -3.177  -0.031  -3.088  1.00 20.00      1AFC
HETATM   29  O63 SCR   969      -2.654   0.972  -5.119  1.00 20.00      1AFC
HETATM   30  O64 SCR   969      -3.912   2.171  -3.575  1.00 20.00      1AFC
HETATM   31  O10 SCR   969       2.573  -1.570  -1.226  1.00 20.00      1AFC
HETATM   32  O51 SCR   969       0.153  -1.415  -4.104  1.00 20.00      1AFC
HETATM   33  O52 SCR   969      -1.588  -1.532  -2.445  1.00 20.00      1AFC
HETATM   34  O53 SCR   969      -1.293  -3.276  -4.059  1.00 20.00      1AFC
HETATM   35  O54 SCR   969      -2.146  -1.220  -4.676  1.00 20.00      1AFC
HETATM   36  O71 SCR   969       0.551  -4.246  -1.658  1.00 20.00      1AFC
HETATM   37  O72 SCR   969      -0.892  -6.126  -1.580  1.00 20.00      1AFC
HETATM   38  O73 SCR   969      -1.784  -3.924  -1.812  1.00 20.00      1AFC
HETATM   39  O74 SCR   969      -0.877  -4.561   0.231  1.00 20.00      1AFC
HETATM   40  O81 SCR   969       2.228  -2.172   2.478  1.00 20.00      1AFC
HETATM   41  O82 SCR   969       3.682  -0.991   3.913  1.00 20.00      1AFC
HETATM   42  O83 SCR   969       1.378  -1.273   4.561  1.00 20.00      1AFC
HETATM   43  O84 SCR   969       1.943   0.146   2.803  1.00 20.00      1AFC
HETATM   44  O91 SCR   969      -0.442  -1.798   0.094  1.00 20.00      1AFC
HETATM   45  O92 SCR   969      -2.158  -0.948   1.389  1.00 20.00      1AFC
HETATM   46  O93 SCR   969       0.035  -0.857   2.151  1.00 20.00      1AFC
HETATM   47  O94 SCR   969      -1.094  -2.975   1.947  1.00 20.00      1AFC
HETATM   48  S2  SCR   969       3.073   3.560   2.362  1.00 20.00      1AFC
HETATM   49  S3  SCR   969      -0.370   2.872   3.284  1.00 20.00      1AFC
HETATM   50  S4  SCR   969      -2.805   2.250   0.579  1.00 20.00      1AFC
HETATM   51  S6  SCR   969      -2.836   1.218  -3.720  1.00 20.00      1AFC
HETATM   52  S11 SCR   969       2.311  -1.086   3.456  1.00 20.00      1AFC
HETATM   53  S12 SCR   969      -0.903  -1.654   1.397  1.00 20.00      1AFC
HETATM   54  S13 SCR   969      -0.740  -4.725  -1.210  1.00 20.00      1AFC
HETATM   55  S14 SCR   969      -1.208  -1.852  -3.797  1.00 20.00      1AFC
REMARK SCR ENDHET
REMARK