Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 8R7

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 C4 C C1 N Y N 0 -0.169 1.255 1.152
2 C14 C C2 N Y N 0 1.051 -2.145 1.401
3 C5 C C3 N Y N 0 -2.469 0.121 0.068
4 C6 C C4 N N N 0 -3.718 -0.485 -0.517
5 C11 C C5 N Y N 0 -1.324 -0.634 0.179
6 C7 C C6 N N N 0 -3.498 -0.814 -2.004
7 C8 C C7 N N N 0 -3.691 -2.338 -2.151
8 C9 C C8 N N N 0 -4.582 -2.726 -0.945
9 C10 C C9 N N N 0 -4.038 -1.819 0.188
10 C12 C C10 N Y N 0 -0.165 -0.071 0.716
11 C13 C C11 N Y N 0 1.07 -0.881 0.824
12 N1 N N1 N Y N 0 3.371 -2.409 1.048
13 C3 C C12 N Y N 0 -1.317 2.009 1.052
14 O1 O O1 N N N 0 -4.038 3.122 1.37
15 C1 C C13 N N N 0 -3.704 2.259 0.391
16 C2 C C14 N Y N 0 -2.476 1.448 0.509
17 C15 C C15 N Y N 0 2.229 -2.876 1.492
18 C16 C C16 N Y N 0 3.463 -1.206 0.47
19 C17 C C17 N Y N 0 4.695 -0.724 0.001
20 C18 C C18 N Y N 0 4.76 0.518 -0.589
21 O2 O O2 N N N 0 5.952 0.984 -1.043
22 C19 C C19 N N N 0 5.955 2.28 -1.646
23 C20 C C20 N Y N 0 3.612 1.304 -0.727
24 C21 C C21 N Y N 0 2.411 0.873 -0.252
25 C22 C C22 N Y N 0 2.31 -0.392 0.343
26 O3 O O3 N N N 0 -4.413 2.149 -0.59
27 H3 H H1 N N N 0 0.727 1.689 1.571
28 H14 H H2 N N N 0 0.126 -2.554 1.781
29 H4 H H3 N N N 0 -4.555 0.206 -0.407
30 H13 H H4 N N N 0 -1.319 -1.659 -0.161
31 H6 H H5 N N N 0 -4.228 -0.284 -2.616
32 H5 H H6 N N N 0 -2.487 -0.535 -2.302
33 H8 H H7 N N N 0 -4.197 -2.569 -3.088
34 H7 H H8 N N N 0 -2.731 -2.851 -2.099
35 H10 H H9 N N N 0 -5.629 -2.502 -1.15
36 H9 H H10 N N N 0 -4.456 -3.779 -0.694
37 H12 H H11 N N N 0 -3.134 -2.249 0.619
38 H11 H H12 N N N 0 -4.797 -1.673 0.957
39 H2 H H13 N N N 0 -1.322 3.034 1.393
40 H1 H H14 N N N 0 -4.851 3.631 1.247
41 H15 H H15 N N N 0 2.203 -3.858 1.943
42 H16 H H16 N N N 0 5.588 -1.324 0.103
43 H19 H H17 N N N 0 6.966 2.53 -1.964
44 H17 H H18 N N N 0 5.292 2.279 -2.511
45 H18 H H19 N N N 0 5.608 3.018 -0.923
46 H20 H H20 N N N 0 3.684 2.276 -1.193
47 H21 H H21 N N N 0 1.532 1.49 -0.364