Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : R0T

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 67


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N Y N 0 -7.967 -0.108 -0.973
2 N3 N N2 N N N 0 1.87 -1.712 -0.686
3 C4 C C1 N Y N 0 -4.569 -0.988 -0.192
4 C5 C C2 N Y N 0 -2.881 -2.679 -0.489
5 C6 C C3 N Y N 0 -1.838 -1.785 -0.678
6 C7 C C4 N Y N 0 -0.52 -2.218 -0.535
7 C8 C C5 N N N 0 0.597 -1.271 -0.735
8 C10 C C6 N Y N 0 4.117 -1.104 -0.047
9 C13 C C7 N Y N 0 7.916 -1.539 1.729
10 C15 C C8 N Y N 0 6.656 -1.66 1.268
11 C22 C C12 N Y N 0 -2.611 -4.002 -0.159
12 C17 C C9 N Y N 0 3.829 1.332 -1.342
13 C20 C C10 N Y N 0 -0.26 -3.549 -0.203
14 C21 C C11 N Y N 0 -1.305 -4.431 -0.018
15 C24 C C13 N Y N 0 -4.045 1.001 0.868
16 C26 C C14 N Y N 0 -1.732 1.351 1.752
17 C28 C C15 N Y N 0 -1.238 3.39 2.893
18 N N N3 N Y N 0 -7.487 1.026 -0.306
19 C C C16 N N N 0 -8.249 2.246 -0.027
20 O O O1 N N N 0 0.368 -0.096 -0.942
21 C1 C C17 N Y N 0 -7.027 -1.006 -1.047
22 C11 C C18 N Y N 0 5.163 -0.194 -0.056
23 C12 C C19 N Y N 0 7.471 0.286 0.664
24 C14 C C20 N N N 0 8.666 -2.571 2.53
25 C16 C C21 N Y N 0 5.016 1.025 -0.705
26 C18 C C22 N N N 0 3.673 2.655 -2.046
27 C19 C C23 N Y N 0 2.788 0.423 -1.344
28 C2 C C24 N Y N 0 -6.188 0.798 0.041
29 C23 C C25 N N N 0 -3.747 -4.972 0.046
30 C25 C C26 N Y N 0 -3.036 1.821 1.58
31 C27 C C27 N Y N 0 -0.827 2.156 2.424
32 C29 C C28 N Y N 0 -3.374 3.075 2.088
33 C3 C C29 N Y N 0 -5.87 -0.494 -0.422
34 C9 C C30 N Y N 0 2.927 -0.796 -0.692
35 F F F1 N N N 0 2.354 3.102 -1.912
36 F1 F F2 N N N 0 4.542 3.591 -1.476
37 N5 N N6 N Y N 0 8.389 -0.344 1.347
38 F2 F F3 N N N 0 3.978 2.5 -3.402
39 N2 N N4 N N N 0 -4.205 -2.249 -0.625
40 N4 N N5 N Y N 0 6.369 -0.504 0.59
41 N6 N N7 N Y N 0 -3.703 -0.214 0.449
42 N7 N N8 N Y N 0 -2.478 3.805 2.72
43 N8 N N9 N Y N 0 -5.254 1.503 0.674
44 H6 H H1 N N N 0 2.053 -2.663 -0.647
45 H5 H H2 N N N 0 -2.046 -0.757 -0.935
46 H7 H H3 N N N 0 4.23 -2.053 0.457
47 H12 H H4 N N N 0 5.999 -2.506 1.405
48 H15 H H5 N N N 0 0.759 -3.889 -0.093
49 H16 H H6 N N N 0 -1.101 -5.46 0.239
50 H20 H H7 N N N 0 -1.438 0.382 1.376
51 H22 H H8 N N N 0 -0.535 4.02 3.417
52 H3 H H12 N N N 0 -7.117 -1.978 -1.508
53 H1 H H9 N N N 0 -8.747 2.151 0.938
54 H2 H H10 N N N 0 -7.572 3.1 -0.005
55 H H H11 N N N 0 -8.995 2.394 -0.808
56 H8 H H13 N N N 0 7.573 1.27 0.23
57 H11 H H14 N N N 0 8.493 -2.402 3.593
58 H10 H H15 N N N 0 8.316 -3.567 2.259
59 H9 H H16 N N N 0 9.732 -2.491 2.319
60 H13 H H17 N N N 0 5.831 1.734 -0.712
61 H14 H H18 N N N 0 1.863 0.663 -1.846
62 H19 H H19 N N N 0 -3.992 -5.449 -0.903
63 H17 H H20 N N N 0 -3.45 -5.732 0.769
64 H18 H H21 N N N 0 -4.619 -4.436 0.42
65 H21 H H22 N N N 0 0.188 1.823 2.58
66 H23 H H23 N N N 0 -4.378 3.451 1.962
67 H4 H H24 N N N 0 -4.867 -2.835 -1.023