Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 77P

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 47


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C4 C C1 N Y N 0 6.06 1.41 0.002
2 C5 C C2 N Y N 0 4.691 1.148 0.0
3 C6 C C3 N Y N 0 3.783 2.205 -0.002
4 C7 C C4 N Y N 0 4.202 -0.253 -0.002
5 C8 C C5 N Y N 0 5.114 -1.31 -0.001
6 C10 C C6 N Y N 0 3.298 -2.886 -0.003
7 C20 C C7 N Y N 0 -6.866 1.453 0.01
8 C21 C C8 N N N 0 -4.488 0.692 0.008
9 C26 C C9 N Y N 0 -7.682 -1.103 -0.002
10 C1 C C10 N Y N 0 4.243 3.506 -0.001
11 C2 C C11 N Y N 0 5.604 3.762 0.002
12 C3 C C12 N Y N 0 6.51 2.714 0.003
13 C9 C C13 N Y N 0 4.664 -2.617 -0.001
14 C11 C C14 N Y N 0 2.378 -1.829 0.001
15 C12 C C15 N Y N 0 2.837 -0.511 0.002
16 F13 F F1 N N N 0 6.05 5.038 0.002
17 C14 C C16 N N N 0 0.929 -2.109 -0.001
18 N15 N N1 N N N 0 0.047 -1.091 0.003
19 O16 O O1 N N N 0 0.532 -3.258 -0.007
20 O17 O O2 N N N 0 2.858 -4.17 -0.004
21 O18 O O3 N N N 0 5.558 -3.642 -0.001
22 C19 C C17 N Y N 0 -5.945 0.41 0.006
23 N22 N N2 N Y N 0 -6.392 -0.845 0.0
24 C23 C C18 N Y N 0 -8.225 1.133 0.008
25 N24 N N3 N N N 0 -3.605 -0.327 0.004
26 O25 O O4 N N N 0 -4.091 1.84 0.014
27 N27 N N4 N Y N 0 -8.586 -0.143 -0.004
28 O28 O O5 N N N 0 -9.162 2.112 0.018
29 C29 C C19 N N N 0 -2.166 -0.049 0.006
30 C30 C C20 N N N 0 -1.392 -1.368 0.001
31 H1 H H1 N N N 0 6.767 0.594 0.008
32 H2 H H2 N N N 0 2.722 2.006 -0.004
33 H3 H H3 N N N 0 6.174 -1.105 0.001
34 H4 H H4 N N N 0 -6.538 2.482 0.019
35 H5 H H5 N N N 0 -8.01 -2.132 -0.012
36 H9 H H9 N N N 0 0.363 -0.174 0.007
37 H6 H H6 N N N 0 3.54 4.326 -0.002
38 H7 H H7 N N N 0 7.571 2.918 0.005
39 H8 H H8 N N N 0 2.132 0.307 0.006
40 H10 H H10 N N N 0 2.73 -4.542 0.879
41 H11 H H11 N N N 0 5.817 -3.938 -0.884
42 H12 H H12 N N N 0 -3.921 -1.243 -0.001
43 H14 H H14 N N N 0 -1.906 0.529 -0.881
44 H15 H H15 N N N 0 -1.907 0.52 0.899
45 H16 H H16 N N N 0 -1.651 -1.938 -0.892
46 H17 H H17 N N N 0 -1.652 -1.946 0.888
47 H13 H H13 N N N 0 -9.435 2.405 -0.863