COMPND W37 N-(6-((1-(4-BROMOPHENYL)ISOQUINOLIN-6-YL)OXY)HEXYL)-N- METHYLPROP-2-EN-1-AMINE
REMARK W37 Part of HIC-Up: http://xray.bmc.uu.se/hicup
REMARK W37 Extracted from PDB file pdb1o6h.ent
REMARK W37 Formula C25 H29 BR N2 O
REMARK W37 Nr of non-hydrogen atoms  29
REMARK W37 Eigen-values covariance X/Y/Z      943.4      88.0      22.5
REMARK W37 Residue type W37
REMARK W37 Residue name   7680
REMARK W37 Original residue name (for O) $A800
REMARK W37  RESOLUTION. 2.80 ANGSTROMS.
REMARK W37 occurs in        0 other PDB entries
REMARK W37
HETATM    1  C3A W37  7680       2.751  -0.963 -11.848  1.00 20.00           C+0
HETATM    2  C2A W37  7680       2.475   0.016 -11.024  1.00 20.00           C+0
HETATM    3  C1A W37  7680       1.181   0.010 -10.252  1.00 20.00           C+0
HETATM    4  N1  W37  7680       1.469   0.008  -8.812  1.00 20.00           N+0
HETATM    5  C1B W37  7680       0.173   0.003  -8.121  1.00 20.00           C+0
HETATM    6  C2B W37  7680       0.400   0.000  -6.608  1.00 20.00           C+0
HETATM    7  C3B W37  7680      -0.950  -0.005  -5.890  1.00 20.00           C+0
HETATM    8  C4B W37  7680      -0.722  -0.007  -4.377  1.00 20.00           C+0
HETATM    9  C5B W37  7680      -2.073  -0.013  -3.658  1.00 20.00           C+0
HETATM   10  C6B W37  7680      -1.845  -0.016  -2.145  1.00 20.00           C+0
HETATM   11  O   W37  7680      -3.107  -0.021  -1.473  1.00 20.00           O+0
HETATM   12  C3C W37  7680      -4.280  -0.035   4.413  1.00 20.00           C+0
HETATM   13  C6C W37  7680      -2.842  -0.023  -0.141  1.00 20.00           C+0
HETATM   14  C4C W37  7680      -4.624  -0.034   3.094  1.00 20.00           C+0
HETATM   15  C7C W37  7680      -1.515  -0.020   0.298  1.00 20.00           C+0
HETATM   16  C8C W37  7680      -1.217  -0.022   1.627  1.00 20.00           C+0
HETATM   17  N2C W37  7680      -3.017  -0.031   4.809  1.00 20.00           N+0
HETATM   18  C1C W37  7680      -2.003  -0.028   3.960  1.00 20.00           C+0
HETATM   19  C8P W37  7680      -2.255  -0.027   2.569  1.00 20.00           C+0
HETATM   20  C4P W37  7680      -3.602  -0.030   2.125  1.00 20.00           C+0
HETATM   21  C5C W37  7680      -3.878  -0.023   0.752  1.00 20.00           C+0
HETATM   22  C1D W37  7680      -0.611  -0.025   4.464  1.00 20.00           C+0
HETATM   23  C2D W37  7680      -0.269   0.750   5.573  1.00 20.00           C+0
HETATM   24  C3D W37  7680       1.028   0.749   6.038  1.00 20.00           C+0
HETATM   25  C4D W37  7680       1.992  -0.019   5.408  1.00 20.00           C+0
HETATM   26  C5D W37  7680       1.659  -0.791   4.308  1.00 20.00           C+0
HETATM   27  C6D W37  7680       0.362  -0.801   3.836  1.00 20.00           C+0
HETATM   28 BR29 W37  7680       3.770  -0.015   6.052  1.00 20.00          BR+0
HETATM   29  C1E W37  7680       2.105   1.297  -8.506  1.00 20.00           C+0
REMARK W37 ENDHET