Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 32D

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 48


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C1 C C1 N Y N 0 4.142 -1.922 -1.603
2 C2 C C2 N Y N 0 2.964 -1.192 -1.589
3 C3 C C3 N Y N 0 2.307 -0.973 -0.403
4 C4 C C4 N Y N 0 2.818 -1.481 0.794
5 C5 C C5 N Y N 0 4.005 -2.215 0.774
6 C6 C C6 N Y N 0 4.659 -2.431 -0.426
7 F7 F F7 N N N 0 4.514 -2.713 1.923
8 C8 C C8 N N N 0 1.902 -1.085 1.882
9 N9 N N9 N N N 0 0.905 -0.392 1.424
10 C10 C C10 S N N 0 1.04 -0.245 -0.03
11 C11 C C11 N Y N 0 -0.142 -0.868 -0.727
12 C12 C C12 N Y N 0 0.024 -1.472 -1.96
13 C13 C C13 N Y N 0 -1.056 -2.046 -2.605
14 C14 C C14 N Y N 0 -2.307 -2.018 -2.022
15 C15 C C15 N Y N 0 -2.479 -1.411 -0.78
16 C16 C C16 N Y N 0 -1.386 -0.839 -0.132
17 C17 C C17 N Y N 0 -3.822 -1.377 -0.147
18 C18 C C18 N Y N 0 -4.928 -1.949 -0.78
19 N19 N N19 N Y N 0 -6.105 -1.897 -0.182
20 C20 C C20 N Y N 0 -6.243 -1.317 0.994
21 N21 N N21 N Y N 0 -5.226 -0.765 1.625
22 C22 C C22 N Y N 0 -4.012 -0.777 1.1
23 C24 C C24 N Y N 0 1.151 1.213 -0.396
24 C25 C C25 N Y N 0 1.928 1.617 -1.47
25 C26 C C26 N Y N 0 2.006 2.963 -1.777
26 N27 N N27 N Y N 0 1.352 3.857 -1.06
27 C28 C C28 N Y N 0 0.604 3.508 -0.032
28 C29 C C29 N Y N 0 0.474 2.181 0.331
29 C30 C C30 N N N 0 -0.122 4.569 0.755
30 F31 F F31 N N N 0 -0.435 5.642 -0.087
31 F32 F F32 N N N 0 -1.3 4.033 1.285
32 N34 N N34 N N N 0 2.083 -1.408 3.21
33 H1 H H1 N N N 0 4.656 -2.098 -2.536
34 H2 H H2 N N N 0 2.563 -0.796 -2.511
35 H6 H H6 N N N 0 5.577 -2.999 -0.443
36 H341 H H341 N N N 0 2.854 -1.931 3.481
37 H342 H H342 N N N 0 1.439 -1.113 3.873
38 H12 H H12 N N N 0 1.0 -1.496 -2.421
39 H16 H H16 N N N 0 -1.514 -0.37 0.833
40 H13 H H13 N N N 0 -0.921 -2.517 -3.568
41 H14 H H14 N N N 0 -3.15 -2.466 -2.527
42 H25 H H25 N N N 0 2.466 0.89 -2.061
43 H18 H H18 N N N 0 -4.823 -2.426 -1.744
44 H22 H H22 N N N 0 -3.183 -0.327 1.625
45 H20 H H20 N N N 0 -7.22 -1.293 1.454
46 H29 H H29 N N N 0 -0.143 1.901 1.171
47 H26 H H26 N N N 0 2.609 3.286 -2.612
48 H30 H H30 N N N 0 0.516 4.919 1.567