Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : CU4

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 50


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C01 C C1 N N N 0 5.486 -3.008 1.449
2 C05 C C2 N Y N 0 3.073 -2.817 -0.011
3 C06 C C3 N Y N 0 1.992 -3.35 0.668
4 C07 C C4 N Y N 0 0.781 -2.688 0.67
5 C08 C C5 N Y N 0 0.648 -1.481 -0.014
6 C09 C C6 N Y N 0 1.741 -0.948 -0.696
7 C10 C C7 N Y N 0 2.947 -1.619 -0.691
8 C11 C C8 N Y N 0 -0.651 -0.765 -0.016
9 C14 C C9 N Y N 0 -2.209 0.898 -0.013
10 C15 C C10 N Y N 0 -0.846 0.688 -0.007
11 C16 C C11 N N N 0 0.205 1.719 0.007
12 C19 C C12 N Y N 0 0.863 4.002 0.124
13 C20 C C13 N Y N 0 0.615 5.17 0.834
14 C21 C C14 N Y N 0 1.599 6.132 0.947
15 C22 C C15 N Y N 0 2.833 5.934 0.354
16 C23 C C16 N Y N 0 3.085 4.771 -0.355
17 C25 C C17 N Y N 0 2.102 3.804 -0.47
18 C26 C C18 N Y N 0 -4.194 -0.513 -0.038
19 C27 C C19 N Y N 0 -5.06 0.575 -0.038
20 C28 C C20 N Y N 0 -6.422 0.374 -0.053
21 C29 C C21 N Y N 0 -6.934 -0.927 -0.069
22 C30 C C22 N Y N 0 -6.061 -2.018 -0.069
23 C31 C C23 N Y N 0 -4.7 -1.808 -0.053
24 C32 C C24 N N N 0 -8.35 -1.14 -0.084
25 F24 F F1 N N N 0 4.291 4.581 -0.934
26 N12 N N1 N Y N 0 -1.845 -1.314 -0.032
27 N13 N N2 N Y N 0 -2.812 -0.305 -0.028
28 N18 N N3 N N N 0 -0.131 3.024 0.014
29 N33 N N4 N N N 0 -9.473 -1.31 -0.096
30 O03 O O1 N N N 0 5.256 -3.238 -1.2
31 O04 O O2 N N N 0 4.27 -5.026 0.197
32 O17 O O3 N N N 0 1.377 1.393 0.011
33 S02 S S1 N N N 0 4.618 -3.663 -0.003
34 H1 H H1 N N N 0 4.903 -3.217 2.345
35 H2 H H2 N N N 0 6.464 -3.482 1.532
36 H3 H H3 N N N 0 5.613 -1.931 1.341
37 H4 H H4 N N N 0 2.096 -4.285 1.197
38 H5 H H5 N N N 0 -0.063 -3.105 1.2
39 H6 H H6 N N N 0 1.644 -0.013 -1.228
40 H7 H H7 N N N 0 3.795 -1.205 -1.216
41 H8 H H8 N N N 0 -2.705 1.858 -0.005
42 H9 H H9 N N N 0 -0.348 5.326 1.297
43 H10 H H10 N N N 0 1.406 7.04 1.498
44 H11 H H11 N N N 0 3.601 6.688 0.443
45 H12 H H12 N N N 0 2.298 2.897 -1.022
46 H13 H H13 N N N 0 -4.663 1.58 -0.026
47 H14 H H14 N N N 0 -7.094 1.219 -0.052
48 H15 H H15 N N N 0 -6.453 -3.024 -0.081
49 H16 H H16 N N N 0 -4.025 -2.651 -0.058
50 H17 H H17 N N N 0 -1.062 3.286 -0.057