Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KU2

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 61


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C1 N N N 0 2.688 1.522 0.097
2 C13 C C2 N N N 0 -4.462 -2.216 0.681
3 C14 C C3 N Y N 0 6.994 -3.355 -1.574
4 C17 C C4 N Y N 0 5.137 -1.807 -0.226
5 C18 C C5 N Y N 0 5.624 -1.394 -1.46
6 C19 C C6 N Y N 0 6.555 -2.166 -2.128
7 C20 C C7 N Y N 0 -9.1 -2.628 -0.972
8 C21 C C8 N Y N 0 -8.4 -2.037 -2.008
9 C22 C C9 N Y N 0 -7.057 -1.75 -1.861
10 C24 C C10 N Y N 0 -7.114 -2.647 0.366
11 C25 C C11 N Y N 0 -8.457 -2.933 0.213
12 C1 C C12 N N N 0 0.181 3.273 0.316
13 C11 C C13 N N N 0 3.608 0.515 -0.544
14 C12 C C14 N N N 0 -2.962 -1.921 0.614
15 C15 C C15 N Y N 0 6.505 -3.775 -0.351
16 C16 C C16 N Y N 0 5.578 -3.005 0.325
17 C2 C C17 N N N 0 -1.276 1.484 0.527
18 C23 C C18 N Y N 0 -6.41 -2.054 -0.672
19 C3 C C19 N N N 0 -2.302 2.331 0.913
20 C4 C C20 N N N 0 -2.011 3.768 0.986
21 C5 C C21 N N N 0 -1.507 0.025 0.433
22 C6 C C22 N N N 0 2.731 4.546 -1.987
23 C7 C C23 N N N 0 1.493 4.853 -1.104
24 C8 C C24 S N N 0 1.567 3.763 -0.014
25 C9 C C25 N N N 0 2.777 2.999 -1.932
26 N1 N N1 N N N 0 -0.065 1.998 0.242
27 N2 N N2 N N N 0 -0.759 4.177 0.684
28 N3 N N3 N N N 0 -2.75 -0.472 0.593
29 N4 N N4 N N N 0 2.372 2.658 -0.556
30 O1 O O1 N N N 0 -3.534 1.849 1.212
31 O2 O O2 N N N 0 -2.869 4.567 1.319
32 O3 O O3 N N N 0 -0.576 -0.725 0.213
33 O4 O O4 N N N 0 2.229 1.309 1.199
34 O5 O O5 N N N 0 -5.089 -1.773 -0.524
35 S1 S S1 N N N 0 3.955 -0.821 0.632
36 CL1 CL CL1 N N N 0 4.973 -3.526 1.867
37 H1 H H1 N N N 0 -4.616 -3.289 0.798
38 H2 H H2 N N N 0 -4.898 -1.691 1.531
39 H3 H H3 N N N 0 7.719 -3.959 -2.101
40 H4 H H4 N N N 0 5.281 -0.466 -1.894
41 H5 H H5 N N N 0 6.94 -1.841 -3.083
42 H6 H H6 N N N 0 -10.151 -2.847 -1.088
43 H7 H H7 N N N 0 -8.904 -1.8 -2.934
44 H8 H H8 N N N 0 -6.511 -1.289 -2.67
45 H9 H H9 N N N 0 -6.613 -2.886 1.293
46 H10 H H10 N N N 0 -9.006 -3.394 1.021
47 H11 H H11 N N N 0 3.131 0.102 -1.433
48 H12 H H12 N N N 0 4.541 1.003 -0.826
49 H13 H H13 N N N 0 -2.468 -2.348 1.487
50 H14 H H14 N N N 0 -2.545 -2.363 -0.291
51 H15 H H15 N N N 0 6.847 -4.706 0.076
52 H16 H H16 N N N 0 2.579 4.897 -3.008
53 H17 H H17 N N N 0 3.634 4.98 -1.559
54 H18 H H18 N N N 0 1.571 5.846 -0.661
55 H19 H H19 N N N 0 0.574 4.761 -1.683
56 H20 H H20 N N N 0 2.041 4.165 0.881
57 H21 H H21 N N N 0 2.076 2.573 -2.65
58 H22 H H22 N N N 0 3.787 2.642 -2.132
59 H23 H H23 N N N 0 -0.532 5.119 0.731
60 H24 H H24 N N N 0 -3.503 0.13 0.693
61 H25 H H25 N N N 0 -4.171 2.529 1.469