PDB Code: J80
X-PLOR files
Heterogen file generated from the file hetero.pdb
COMPND J80 (METHYLPYRIDAZINE PIPERIDINE BUTYLOXYPHENYL) ETHYLACETATE
REMARK J80 Extracted from PDB file 1vbb.pdb
REMARK J80 Formula C23 H31 N3 O3
REMARK J80 Nr of non-hydrogen atoms 29
REMARK J80 Residue type J80
REMARK J80 Residue name 642
REMARK J80 Original residue name (for O) $500
REMARK 2 RESOLUTION. 2.8 ANGSTROMS. J80
HETATM 1 C1 J80 642 -5.811 8.201 -2.140 1.00 20.00
HETATM 2 C2 J80 642 -5.012 6.936 -2.067 1.00 20.00
HETATM 3 C3 J80 642 -3.977 6.848 -2.945 1.00 20.00
HETATM 4 C4 J80 642 -3.151 5.733 -2.861 1.00 20.00
HETATM 5 C5 J80 642 -3.403 4.744 -1.913 1.00 20.00
HETATM 6 N4 J80 642 -4.454 4.915 -1.083 1.00 20.00
HETATM 7 N3 J80 642 -5.257 5.991 -1.151 1.00 20.00
HETATM 8 N6 J80 642 -2.495 3.763 -1.807 1.00 20.00
HETATM 9 C7 J80 642 -2.577 2.882 -0.643 1.00 20.00
HETATM 10 C8 J80 642 -1.566 1.744 -0.668 1.00 20.00
HETATM 11 C9 J80 642 -0.231 2.137 -1.225 1.00 20.00
HETATM 12 C10 J80 642 -0.365 2.574 -2.634 1.00 20.00
HETATM 13 C11 J80 642 -1.460 3.610 -2.863 1.00 20.00
HETATM 14 C12 J80 642 0.799 1.056 -1.018 1.00 20.00
HETATM 15 C13 J80 642 0.575 -0.137 -1.903 1.00 20.00
HETATM 16 C14 J80 642 1.268 -1.352 -1.352 1.00 20.00
HETATM 17 C15 J80 642 0.387 -1.929 -0.278 1.00 20.00
HETATM 18 O16 J80 642 0.399 -3.355 -0.378 1.00 20.00
HETATM 19 C17 J80 642 1.169 -4.018 0.530 1.00 20.00
HETATM 20 C18 J80 642 1.237 -3.636 1.861 1.00 20.00
HETATM 21 C19 J80 642 2.187 -4.226 2.687 1.00 20.00
HETATM 22 C20 J80 642 3.069 -5.186 2.198 1.00 20.00
HETATM 23 C21 J80 642 2.983 -5.574 0.865 1.00 20.00
HETATM 24 C22 J80 642 2.022 -4.979 0.034 1.00 20.00
HETATM 25 C23 J80 642 4.067 -5.684 3.015 1.00 20.00
HETATM 26 O24 J80 642 5.035 -6.297 2.545 1.00 20.00
HETATM 27 O25 J80 642 3.883 -5.491 4.443 1.00 20.00
HETATM 28 C26 J80 642 4.993 -5.330 5.256 1.00 20.00
HETATM 29 C27 J80 642 5.676 -3.953 5.507 1.00 20.00
REMARK J80 ENDHET
REMARK