Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 97X

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 49


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N N N 0 -2.806 0.743 2.87
2 C4 C C1 N Y N 0 -3.448 -1.065 -0.065
3 C7 C C2 N Y N 0 -3.401 -1.409 -1.437
4 C8 C C3 N Y N 0 -2.66 -0.615 -2.333
5 C10 C C4 N Y N 0 -2.021 0.846 -0.534
6 N12 N N2 N Y N 0 -1.767 3.314 -0.015
7 C13 C C5 N N N 0 -3.117 3.743 -0.388
8 C15 C C6 N Y N 0 0.318 3.417 0.697
9 C17 C C7 N Y N 0 0.958 0.931 0.478
10 C20 C C8 N Y N 0 2.661 -1.249 0.696
11 C21 C C9 N Y N 0 3.098 -0.071 0.045
12 C22 C C10 N Y N 0 2.235 1.017 -0.065
13 C11 C C11 N Y N 0 -1.286 2.04 -0.079
14 C16 C C12 N Y N 0 0.032 2.081 0.366
15 C18 C C13 N Y N 0 0.539 -0.239 1.124
16 C19 C C14 N Y N 0 1.375 -1.312 1.233
17 C2 C C15 N N N 0 -2.78 0.45 1.773
18 C23 C C16 N N N 0 4.454 -0.038 -0.507
19 C27 C C17 N N N 0 3.597 -2.374 0.794
20 C29 C C18 N N N 0 4.953 1.201 -1.207
21 C3 C C19 N Y N 0 -2.747 0.08 0.389
22 C31 C C20 N Y N 0 -4.097 -2.545 -1.885
23 C32 C C21 N Y N 0 -4.805 -3.296 -0.996
24 C33 C C22 N Y N 0 -4.851 -2.955 0.354
25 C34 C C23 N Y N 0 -4.182 -1.864 0.823
26 C9 C C24 N Y N 0 -1.991 0.481 -1.889
27 N30 N N6 N N N 0 6.331 0.982 -1.666
28 N14 N N3 N Y N 0 -0.745 4.141 0.464
29 N24 N N4 N N N 0 5.227 -1.076 -0.394
30 N25 N N5 N N N 0 4.83 -2.242 0.262
31 O28 O O1 N N N 0 3.274 -3.402 1.362
32 H1 H H1 N N N 0 -2.623 -0.878 -3.38
33 H2 H H2 N N N 0 -3.772 3.681 0.481
34 H3 H H3 N N N 0 -3.085 4.773 -0.745
35 H4 H H4 N N N 0 -3.499 3.097 -1.178
36 H5 H H5 N N N 0 1.259 3.784 1.08
37 H6 H H6 N N N 0 2.554 1.919 -0.567
38 H7 H H7 N N N 0 -0.456 -0.292 1.541
39 H8 H H8 N N N 0 1.039 -2.211 1.73
40 H9 H H9 N N N 0 4.314 1.416 -2.063
41 H10 H H10 N N N 0 4.929 2.043 -0.515
42 H11 H H11 N N N 0 -4.07 -2.821 -2.928
43 H12 H H12 N N N 0 -5.339 -4.168 -1.343
44 H13 H H13 N N N 0 -5.419 -3.566 1.038
45 H14 H H14 N N N 0 -4.226 -1.61 1.872
46 H15 H H15 N N N 0 -1.427 1.079 -2.589
47 H16 H H16 N N N 0 5.452 -2.983 0.325
48 H18 H H18 N N N 0 6.688 1.798 -2.138
49 H17 H H17 N N N 0 6.39 0.167 -2.257