Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 70X

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 57


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C27 C C1 N Y N 0 -8.427 0.205 1.274
2 C28 C C2 N Y N 0 -7.501 1.029 1.887
3 C29 C C3 N Y N 0 -6.321 1.344 1.24
4 C26 C C4 N Y N 0 -8.169 -0.31 0.017
5 C25 C C5 N Y N 0 -6.988 0.004 -0.63
6 C24 C C6 N Y N 0 -6.066 0.834 -0.02
7 C23 C C7 N N N 0 -4.779 1.178 -0.725
8 C14 C C8 N Y N 0 0.76 -1.541 -0.772
9 C15 C C9 N Y N 0 -0.2 -0.603 -1.097
10 C16 C C10 N Y N 0 -1.484 -0.709 -0.561
11 C17 C C11 N Y N 0 -1.789 -1.765 0.301
12 C18 C C12 N Y N 0 -0.821 -2.695 0.617
13 C19 C C13 N Y N 0 0.45 -2.584 0.082
14 C20 C C14 N N N 0 -2.516 0.291 -0.904
15 N1 N N1 N N N 0 3.675 1.5 0.327
16 C2 C C15 S N N 0 4.883 0.914 0.934
17 C3 C C16 N N N 0 4.511 -0.46 1.502
18 C4 C C17 N N N 0 3.682 -1.224 0.509
19 N5 N N2 N N N 0 2.985 -0.623 -0.467
20 C6 C C18 N N N 0 3.043 0.745 -0.646
21 N7 N N3 N N N 0 2.528 1.309 -1.7
22 O8 O O1 N N N 0 3.644 -2.433 0.59
23 C9 C C19 N N N 0 2.145 -1.431 -1.354
24 C10 C C20 N N N 0 5.971 0.755 -0.13
25 C11 C C21 N N N 0 5.389 1.819 2.059
26 C12 C C22 N N N 0 6.334 2.129 -0.697
27 C13 C C23 N N N 0 7.212 0.119 0.499
28 O21 O O2 N N N 0 -2.248 1.209 -1.654
29 N22 N N4 N N N 0 -3.756 0.186 -0.385
30 H1 H H1 N N N 0 -9.349 -0.041 1.779
31 H2 H H2 N N N 0 -7.701 1.427 2.871
32 H3 H H3 N N N 0 -5.598 1.988 1.718
33 H4 H H4 N N N 0 -8.89 -0.957 -0.46
34 H5 H H5 N N N 0 -6.787 -0.398 -1.612
35 H6 H H6 N N N 0 -4.944 1.175 -1.803
36 H7 H H7 N N N 0 -4.445 2.167 -0.411
37 H8 H H8 N N N 0 0.043 0.211 -1.763
38 H9 H H9 N N N 0 -2.781 -1.852 0.719
39 H10 H H10 N N N 0 -1.056 -3.511 1.283
40 H11 H H11 N N N 0 1.205 -3.315 0.333
41 H12 H H12 N N N 0 5.421 -1.019 1.719
42 H13 H H13 N N N 0 3.94 -0.328 2.42
43 H14 H H14 N N N 0 2.578 2.271 -1.809
44 H16 H H16 N N N 0 2.576 -2.427 -1.456
45 H17 H H17 N N N 0 2.091 -0.957 -2.335
46 H18 H H18 N N N 0 5.603 0.117 -0.933
47 H19 H H19 N N N 0 4.615 1.919 2.82
48 H20 H H20 N N N 0 6.282 1.381 2.504
49 H21 H H21 N N N 0 5.63 2.802 1.654
50 H22 H H22 N N N 0 6.788 2.737 0.087
51 H23 H H23 N N N 0 7.041 2.009 -1.518
52 H24 H H24 N N N 0 5.433 2.621 -1.062
53 H25 H H25 N N N 0 6.953 -0.86 0.903
54 H26 H H26 N N N 0 7.987 0.006 -0.259
55 H27 H H27 N N N 0 7.58 0.757 1.303
56 H29 H H29 N N N 0 3.338 2.369 0.599
57 H28 H H28 N N N 0 -3.97 -0.546 0.213