COMPND YOL ((2,2p-(4-CARBOXY-1,2- PHENYLENEBIS(NITRILOMETHYLIDYNE))BIS(PHENOLATO))(2-)- N,Np,O,Op)-IRON; SALOPHEN-10-CARBOXYLATE IRON CHELATE
REMARK YOL Part of HIC-Up: http://xray.bmc.uu.se/hicup
REMARK YOL Extracted from PDB file pdb1wzf.ent
REMARK YOL Formula C21 H14 FE N2 O4 2+
REMARK YOL Nr of non-hydrogen atoms  28
REMARK YOL Eigen-values covariance X/Y/Z      268.9     208.1       8.8
REMARK YOL Residue type YOL
REMARK YOL Residue name   7820
REMARK YOL Original residue name (for O) $A901
REMARK YOL  RESOLUTION. 1.85 ANGSTROMS.
REMARK YOL occurs in        0 other PDB entries
REMARK YOL
HETATM    1  O2A YOL  7820       5.971   2.600  -0.013  1.00 20.00           O+0
HETATM    2  CAA YOL  7820       5.276   1.446  -0.016  1.00 20.00           C+0
HETATM    3  O1A YOL  7820       5.863   0.383  -0.029  1.00 20.00           O+0
HETATM    4  CC5 YOL  7820       3.801   1.474  -0.002  1.00 20.00           C+0
HETATM    5  CC6 YOL  7820       3.083   0.284  -0.003  1.00 20.00           C+0
HETATM    6  CC1 YOL  7820       1.674   0.308   0.008  1.00 20.00           C+0
HETATM    7  CC2 YOL  7820       1.015   1.525   0.016  1.00 20.00           C+0
HETATM    8  CC3 YOL  7820       1.764   2.727   0.022  1.00 20.00           C+0
HETATM    9  CC4 YOL  7820       3.123   2.699   0.013  1.00 20.00           C+0
HETATM   10  NA  YOL  7820       0.873  -0.807   0.010  1.00 20.00           N+1
HETATM   11  CA  YOL  7820       1.293  -2.035   0.006  1.00 20.00           C+0
HETATM   12  CA1 YOL  7820       0.448  -3.223   0.000  1.00 20.00           C+0
HETATM   13  CA6 YOL  7820       1.059  -4.487  -0.008  1.00 20.00           C+0
HETATM   14  CA5 YOL  7820       0.290  -5.628  -0.015  1.00 20.00           C+0
HETATM   15  CA4 YOL  7820      -1.092  -5.530  -0.014  1.00 20.00           C+0
HETATM   16  CA3 YOL  7820      -1.704  -4.295  -0.006  1.00 20.00           C+0
HETATM   17  CA2 YOL  7820      -0.945  -3.123   0.002  1.00 20.00           C+0
HETATM   18  OA  YOL  7820      -1.592  -1.960   0.009  1.00 20.00           O+0
HETATM   19 FE   YOL  7820      -0.927  -0.311   0.020  1.00 20.00          FE+0
HETATM   20  OB  YOL  7820      -2.670   0.041   0.009  1.00 20.00           O+0
HETATM   21  CB2 YOL  7820      -3.285   1.220  -0.003  1.00 20.00           C+0
HETATM   22  CB3 YOL  7820      -4.682   1.230  -0.014  1.00 20.00           C+0
HETATM   23  CB4 YOL  7820      -5.378   2.419  -0.026  1.00 20.00           C+0
HETATM   24  CB5 YOL  7820      -4.701   3.628  -0.026  1.00 20.00           C+0
HETATM   25  CB6 YOL  7820      -3.326   3.645  -0.014  1.00 20.00           C+0
HETATM   26  CB1 YOL  7820      -2.605   2.440  -0.003  1.00 20.00           C+0
HETATM   27  CB  YOL  7820      -1.149   2.493   0.006  1.00 20.00           C+0
HETATM   28  NB  YOL  7820      -0.353   1.466   0.014  1.00 20.00           N+1
REMARK YOL ENDHET