COMPND CLQ N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4- DIAMINE; CHLOROQUINE
REMARK CLQ Part of HIC-Up: http://xray.bmc.uu.se/hicup
REMARK CLQ Extracted from PDB file pdb1cet.ent
REMARK CLQ Formula C18 H26 CL N3
REMARK CLQ Nr of non-hydrogen atoms  22
REMARK CLQ Eigen-values covariance X/Y/Z      296.0      42.9      29.2
REMARK CLQ Residue type CLQ
REMARK CLQ Residue name   2534
REMARK CLQ Original residue name (for O) $1001
REMARK CLQ  RESOLUTION. 2.05 ANGSTROMS.
REMARK CLQ occurs in        0 other PDB entries
REMARK CLQ
HETATM    1 CL   CLQ  2534       2.515   0.348  -5.327  1.00 20.00          CL+0
HETATM    2  N1  CLQ  2534      -1.631  -1.671  -3.225  1.00 20.00           N+0
HETATM    3  C1  CLQ  2534      -2.535  -1.779  -2.278  1.00 20.00           C+0
HETATM    4  C2  CLQ  2534      -2.504  -0.982  -1.143  1.00 20.00           C+0
HETATM    5  C3  CLQ  2534      -1.497  -0.041  -0.991  1.00 20.00           C+0
HETATM    6  C4  CLQ  2534      -0.534   0.069  -2.022  1.00 20.00           C+0
HETATM    7  C5  CLQ  2534       0.518   0.991  -1.940  1.00 20.00           C+0
HETATM    8  C6  CLQ  2534       1.431   1.063  -2.949  1.00 20.00           C+0
HETATM    9  C7  CLQ  2534       1.334   0.227  -4.060  1.00 20.00           C+0
HETATM   10  C8  CLQ  2534       0.326  -0.683  -4.167  1.00 20.00           C+0
HETATM   11  C9  CLQ  2534      -0.632  -0.786  -3.146  1.00 20.00           C+0
HETATM   12  N2  CLQ  2534      -1.440   0.770   0.131  1.00 20.00           N+0
HETATM   13  C10 CLQ  2534      -2.453   0.640   1.181  1.00 20.00           C+0
HETATM   14  C11 CLQ  2534      -1.838   1.011   2.531  1.00 20.00           C+0
HETATM   15  C12 CLQ  2534      -0.667   0.074   2.834  1.00 20.00           C+0
HETATM   16  C13 CLQ  2534      -0.052   0.445   4.185  1.00 20.00           C+0
HETATM   17  N3  CLQ  2534       1.128  -0.392   4.432  1.00 20.00           N+0
HETATM   18  C14 CLQ  2534       2.208   0.140   3.591  1.00 20.00           C+0
HETATM   19  C15 CLQ  2534       3.475  -0.690   3.801  1.00 20.00           C+0
HETATM   20  C16 CLQ  2534       1.525  -0.161   5.827  1.00 20.00           C+0
HETATM   21  C17 CLQ  2534       0.642  -0.998   6.755  1.00 20.00           C+0
HETATM   22  C18 CLQ  2534      -3.624   1.577   0.878  1.00 20.00           C+0
REMARK CLQ ENDHET