COMPND BYP (2R)-1-(4-((4-ANILINO-5-BROMOPYRIMIDIN-2-YL) AMINO)PHENOXY)-3-(DIMETHYLAMINO)PROPAN-2-OL
REMARK BYP Part of HIC-Up: http://xray.bmc.uu.se/hicup
REMARK BYP Extracted from PDB file pdb1h08.ent
REMARK BYP Formula C21 H24 BR N5 O2
REMARK BYP Nr of non-hydrogen atoms  29
REMARK BYP Eigen-values covariance X/Y/Z      561.2     137.5       7.4
REMARK BYP Residue type BYP
REMARK BYP Residue name   2204
REMARK BYP Original residue name (for O) $A299
REMARK BYP  RESOLUTION. 1.80 ANGSTROMS.
REMARK BYP occurs in        0 other PDB entries
REMARK BYP
HETATM    1  C22 BYP  2204       0.142  -0.056   5.625  1.00 20.00           C+0
HETATM    2  N1  BYP  2204      -1.094  -0.026  -1.186  1.00 20.00           N+0
HETATM    3  C2  BYP  2204      -1.978   0.091  -2.166  1.00 20.00           C+0
HETATM    4  C6  BYP  2204       0.201  -0.123  -1.446  1.00 20.00           C+0
HETATM    5  C4  BYP  2204      -0.165   0.010  -3.718  1.00 20.00           C+0
HETATM    6  C3  BYP  2204      -1.537   0.114  -3.476  1.00 20.00           C+0
HETATM    7  N5  BYP  2204       0.665  -0.100  -2.687  1.00 20.00           N+0
HETATM    8  C11 BYP  2204       4.432   0.072  -5.694  1.00 20.00           C+0
HETATM    9  C10 BYP  2204       3.593  -0.578  -6.580  1.00 20.00           C+0
HETATM   10  C9  BYP  2204       2.230  -0.594  -6.358  1.00 20.00           C+0
HETATM   11  C8  BYP  2204       1.702   0.043  -5.244  1.00 20.00           C+0
HETATM   12  C12 BYP  2204       3.909   0.709  -4.583  1.00 20.00           C+0
HETATM   13  C17 BYP  2204      -1.028  -1.186   2.458  1.00 20.00           C+0
HETATM   14  C16 BYP  2204      -0.559  -1.064   1.165  1.00 20.00           C+0
HETATM   15  C13 BYP  2204       2.547   0.701  -4.358  1.00 20.00           C+0
HETATM   16  C15 BYP  2204       0.617  -0.370   0.916  1.00 20.00           C+0
HETATM   17  C18 BYP  2204      -0.324  -0.617   3.508  1.00 20.00           C+0
HETATM   18  C19 BYP  2204       0.848   0.080   3.261  1.00 20.00           C+0
HETATM   19  C20 BYP  2204       1.321   0.199   1.969  1.00 20.00           C+0
HETATM   20  O21 BYP  2204      -0.787  -0.738   4.781  1.00 20.00           O+0
HETATM   21  N7  BYP  2204       0.323   0.029  -5.016  1.00 20.00           N+0
HETATM   22  N14 BYP  2204       1.093  -0.245  -0.394  1.00 20.00           N+0
HETATM   23 BR   BYP  2204      -2.762   0.282  -4.906  1.00 20.00          BR+0
HETATM   24  C23 BYP  2204      -0.321  -0.154   7.080  1.00 20.00           C+0
HETATM   25  C24 BYP  2204       0.673   0.574   7.984  1.00 20.00           C+0
HETATM   26  N25 BYP  2204       0.258   0.432   9.385  1.00 20.00           N+0
HETATM   27  C26 BYP  2204       0.618  -0.931   9.796  1.00 20.00           C+0
HETATM   28  C27 BYP  2204       1.099   1.345  10.170  1.00 20.00           C+0
HETATM   29  O28 BYP  2204      -1.612   0.445   7.210  1.00 20.00           O+0
REMARK BYP ENDHET