Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : RWT

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 47


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 1.476 0.422 0.877
2 C4 C C1 N Y N 0 -3.924 -0.614 -1.053
3 C5 C C2 N Y N 0 -4.558 0.597 -0.856
4 C6 C C3 N Y N 0 -4.011 1.517 0.021
5 C7 C C4 N Y N 0 -2.838 1.225 0.686
6 C8 C C5 N Y N 0 -2.19 0.01 0.486
7 C10 C C6 N Y N 0 2.522 0.914 0.087
8 C13 C C7 N Y N 0 4.794 0.859 -0.631
9 C15 C C8 N N N 0 6.438 -0.522 0.633
10 C17 C C9 N N N 0 4.018 -0.795 1.12
11 O2 O O1 N N N 0 -0.021 0.887 -0.693
12 C9 C C10 N N N 0 0.218 0.407 0.395
13 C1 C C11 S N N 0 -0.893 -0.207 1.208
14 CL CL CL1 N N N 0 -4.803 3.039 0.286
15 C3 C C12 N Y N 0 -2.755 -0.908 -0.374
16 S S S1 N N N 0 -1.992 -2.482 -0.633
17 O O O2 N N N 0 -1.701 -2.574 -2.021
18 O1 O O3 N N N 0 -2.776 -3.438 0.068
19 N N N2 N N N 0 -0.53 -2.384 0.162
20 C2 C C13 N N N 0 -0.561 -1.669 1.454
21 C C C14 N N N 0 -0.961 0.509 2.558
22 C18 C C15 N Y N 0 3.795 0.346 0.167
23 C16 C C16 N N N 0 5.303 -1.543 0.765
24 C14 C C17 N N N 0 6.196 0.313 -0.624
25 C12 C C18 N Y N 0 4.5 1.919 -1.477
26 N2 N N3 N Y N 0 3.288 2.432 -1.533
27 C11 C C19 N Y N 0 2.305 1.968 -0.789
28 H1 H H1 N N N 0 1.658 0.088 1.769
29 H2 H H2 N N N 0 -4.345 -1.337 -1.736
30 H3 H H3 N N N 0 -5.473 0.825 -1.384
31 H4 H H4 N N N 0 -2.418 1.948 1.369
32 H5 H H5 N N N 0 6.45 0.129 1.507
33 H6 H H6 N N N 0 7.392 -1.043 0.552
34 H7 H H7 N N N 0 4.095 -0.407 2.135
35 H8 H H8 N N N 0 3.175 -1.484 1.06
36 H9 H H9 N N N 0 0.283 -2.771 -0.199
37 H10 H H10 N N N 0 0.413 -1.746 1.936
38 H11 H H11 N N N 0 -1.322 -2.112 2.097
39 H12 H H12 N N N 0 -1.222 1.556 2.401
40 H13 H H13 N N N 0 -1.717 0.035 3.183
41 H14 H H14 N N N 0 0.009 0.447 3.051
42 H15 H H15 N N N 0 5.172 -2.07 -0.18
43 H16 H H16 N N N 0 5.542 -2.256 1.555
44 H17 H H17 N N N 0 6.343 -0.312 -1.505
45 H18 H H18 N N N 0 6.905 1.14 -0.65
46 H19 H H19 N N N 0 5.279 2.329 -2.104
47 H20 H H20 N N N 0 1.322 2.411 -0.862