Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : S35

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 65


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C35 C C35 N N N 0 5.969 2.437 0.768
2 C30 C C30 N Y N 0 5.48 1.972 -0.58
3 C31 C C31 N Y N 0 5.972 2.556 -1.733
4 C32 C C32 N Y N 0 5.524 2.13 -2.969
5 C33 C C33 N Y N 0 4.585 1.119 -3.053
6 C34 C C34 N Y N 0 4.094 0.534 -1.9
7 C29 C C29 N Y N 0 4.545 0.958 -0.664
8 C24 C C24 S N N 0 4.014 0.317 0.592
9 C25 C C25 N N N 0 4.95 -0.815 1.022
10 C26 C C26 N N N 0 4.493 -1.368 2.347
11 O28 O O28 N N N 0 3.581 -0.841 2.94
12 O27 O O27 N N N 0 5.099 -2.446 2.869
13 N23 N N23 N N N 0 2.678 -0.226 0.336
14 C21 C C21 N N N 0 1.598 0.578 0.411
15 O22 O O22 N N N 0 1.741 1.771 0.6
16 C10 C C10 N Y N 0 0.243 0.011 0.262
17 N9 N N9 N Y N 0 -0.046 -1.26 0.054
18 C11 C C11 N Y N 0 -0.968 0.731 0.324
19 C12 C C12 N Y N 0 -1.984 -0.148 0.141
20 O13 O O13 N N N 0 -3.308 0.15 0.131
21 C14 C C14 N N N 0 -3.663 1.532 0.218
22 C15 C C15 R N N 0 -5.184 1.663 0.306
23 C17 C C17 N N N 0 -5.558 3.132 0.516
24 C19 C C19 N N N 0 -5.064 3.959 -0.672
25 C20 C C20 N N N 0 -7.078 3.26 0.63
26 C18 C C18 N N N 0 -4.905 3.645 1.801
27 C5 C C5 N Y N 0 -3.235 -2.891 0.56
28 O16 O O16 N N N 0 -5.774 1.191 -0.907
29 N8 N N8 N Y N 0 -1.439 -1.384 -0.027
30 C6 C C6 N Y N 0 -2.148 -2.574 -0.243
31 C4 C C4 N Y N 0 -3.932 -4.064 0.346
32 C3 C C3 N Y N 0 -3.549 -4.924 -0.667
33 C2 C C2 N Y N 0 -2.467 -4.613 -1.469
34 C1 C C1 N Y N 0 -1.768 -3.437 -1.264
35 F7 F F7 N N N 0 -0.714 -3.13 -2.052
36 H351 H H351 N N N 0 5.333 3.247 1.125
37 H352 H H352 N N N 0 5.931 1.608 1.474
38 H353 H H353 N N N 0 6.995 2.793 0.679
39 H31 H H31 N N N 0 6.706 3.346 -1.667
40 H32 H H32 N N N 0 5.907 2.587 -3.869
41 H33 H H33 N N N 0 4.234 0.786 -4.018
42 H34 H H34 N N N 0 3.36 -0.255 -1.966
43 H24 H H24 N N N 0 3.958 1.063 1.385
44 H251 H H251 N N N 0 4.932 -1.606 0.273
45 H252 H H252 N N N 0 5.965 -0.429 1.12
46 H23 H H23 N N N 0 2.569 -1.163 0.113
47 H27 H H27 N N N 0 4.771 -2.765 3.721
48 H11 H H11 N N N 0 -1.069 1.794 0.488
49 H141 H H141 N N N 0 -3.208 1.968 1.108
50 H142 H H142 N N N 0 -3.303 2.056 -0.668
51 H15 H H15 N N N 0 -5.553 1.071 1.143
52 H16 H H16 N N N 0 -5.491 1.673 -1.696
53 H191 H H191 N N N 0 -5.588 3.648 -1.575
54 H192 H H192 N N N 0 -5.258 5.016 -0.486
55 H193 H H193 N N N 0 -3.993 3.805 -0.803
56 H201 H H201 N N N 0 -7.431 2.671 1.476
57 H202 H H202 N N N 0 -7.345 4.307 0.78
58 H203 H H203 N N N 0 -7.543 2.895 -0.286
59 H181 H H181 N N N 0 -3.822 3.554 1.72
60 H182 H H182 N N N 0 -5.172 4.692 1.951
61 H183 H H183 N N N 0 -5.258 3.056 2.648
62 H5 H H5 N N N 0 -3.536 -2.221 1.352
63 H4 H H4 N N N 0 -4.778 -4.311 0.971
64 H2 H H2 N N N 0 -2.169 -5.287 -2.259
65 H3 H H3 N N N 0 -4.095 -5.841 -0.831