Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : R0S

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 60


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 2.99 -0.579 -3.853
2 C15 C C2 N N N 0 -1.056 0.679 2.214
3 C17 C C3 N Y N 0 -1.922 -1.094 0.633
4 C20 C C4 N Y N 0 -4.76 -2.16 -1.702
5 C22 C C5 N Y N 0 -5.551 -1.037 -1.492
6 C24 C C6 N Y N 0 -3.92 -0.146 0.02
7 C26 C C7 N N N 0 -3.727 1.962 1.393
8 C28 C C8 N N N 0 -3.903 4.399 0.872
9 C01 C C9 N N N 0 7.856 1.12 -1.646
10 C03 C C10 N Y N 0 5.572 0.478 -1.471
11 C04 C C11 N Y N 0 5.673 0.703 -0.108
12 C05 C C12 N Y N 0 4.575 0.506 0.709
13 C06 C C13 N Y N 0 3.371 0.082 0.166
14 C07 C C14 N Y N 0 3.266 -0.144 -1.2
15 C08 C C15 N Y N 0 4.365 0.054 -2.019
16 C12 C C16 N N N 0 1.129 0.617 0.992
17 C16 C C17 N Y N 0 -2.059 0.085 1.26
18 C18 C C18 N Y N 0 -3.118 -1.282 -0.192
19 C19 C C19 N Y N 0 -3.549 -2.288 -1.059
20 C23 C C20 N Y N 0 -5.139 -0.037 -0.64
21 C27 C C21 N N N 0 -3.311 3.064 0.417
22 C29 C C22 N N N 0 -3.584 5.44 -0.118
23 C31 C C23 N Y N 0 0.874 -0.943 2.552
24 C32 C C24 N Y N 0 0.487 -1.808 3.56
25 C34 C C25 N Y N 0 2.49 -2.954 3.425
26 C35 C C26 N Y N 0 2.951 -2.134 2.414
27 C36 C C27 N Y N 0 2.134 -1.105 1.962
28 N11 N N1 N N N 0 2.258 -0.117 0.997
29 N14 N N2 N N N 0 0.275 0.143 1.92
30 N25 N N3 N Y N 0 -3.245 0.668 0.903
31 N30 N N4 N N N 0 -3.338 6.244 -0.882
32 N33 N N5 N Y N 0 1.296 -2.772 3.959
33 O02 O O1 N N N 0 6.652 0.678 -2.275
34 O09 O O2 N N N 0 4.265 -0.167 -3.357
35 O13 O O3 N N N 0 0.915 1.569 0.264
36 CL21 CL CL1 N N N 0 -5.301 -3.408 -2.781
37 H1 H H1 N N N 0 2.721 -1.538 -3.411
38 H2 H H2 N N N 0 2.24 0.167 -3.59
39 H3 H H3 N N N 0 3.037 -0.679 -4.938
40 H4 H H4 N N N 0 -1.044 1.763 2.101
41 H5 H H5 N N N 0 -1.333 0.424 3.237
42 H6 H H6 N N N 0 -1.087 -1.773 0.718
43 H7 H H7 N N N 0 -6.499 -0.948 -2.003
44 H8 H H8 N N N 0 -3.296 2.163 2.373
45 H9 H H9 N N N 0 -4.814 1.938 1.472
46 H10 H H10 N N N 0 -4.985 4.304 0.964
47 H11 H H11 N N N 0 -3.479 4.674 1.838
48 H12 H H12 N N N 0 8.636 1.24 -2.398
49 H13 H H13 N N N 0 7.679 2.075 -1.151
50 H14 H H14 N N N 0 8.173 0.382 -0.908
51 H15 H H15 N N N 0 6.609 1.032 0.317
52 H16 H H16 N N N 0 4.656 0.681 1.772
53 H17 H H17 N N N 0 2.329 -0.474 -1.623
54 H18 H H18 N N N 0 -2.937 -3.162 -1.224
55 H19 H H19 N N N 0 -5.762 0.832 -0.485
56 H20 H H20 N N N 0 -2.224 3.137 0.394
57 H21 H H21 N N N 0 -3.68 2.824 -0.581
58 H22 H H22 N N N 0 -0.481 -1.693 4.023
59 H23 H H23 N N N 0 3.116 -3.757 3.785
60 H24 H H24 N N N 0 3.929 -2.289 1.984