Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 0GU

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 78


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C10 C C10 N N N 0 6.524 1.541 -0.167
2 C15 C C15 N Y N 0 4.475 2.231 0.706
3 C16 C C16 N Y N 0 4.155 1.189 -0.158
4 C17 C C17 N Y N 0 2.84 0.937 -0.491
5 C19 C C19 N Y N 0 1.828 1.724 0.028
6 C2 C C2 N N N 0 6.973 -1.692 -1.704
7 C20 C C20 N Y N 0 2.135 2.766 0.883
8 C22 C C22 N Y N 0 3.449 3.022 1.223
9 C24 C C24 N N N 0 0.393 1.446 -0.338
10 C27 C C27 S N N 0 -0.208 0.46 0.665
11 C29 C C29 S N N 0 -1.694 0.28 0.37
12 C3 C C3 N N N 0 6.807 -0.371 -2.459
13 C31 C C31 R N N 0 -2.375 -0.496 1.495
14 C33 C C33 N N N 0 -1.912 -1.954 1.48
15 C37 C C37 N N N 0 0.513 -0.885 0.549
16 C44 C C44 N N N 0 -4.225 -1.115 0.06
17 C47 C C47 N Y N 0 -5.722 -1.044 -0.098
18 C48 C C48 N Y N 0 -6.298 0.024 -0.759
19 C50 C C50 N Y N 0 -7.672 0.088 -0.903
20 C51 C C51 N Y N 0 -8.468 -0.916 -0.386
21 C53 C C53 N Y N 0 -7.892 -1.985 0.275
22 C55 C C55 N Y N 0 -6.518 -2.052 0.414
23 C57 C C57 N N N 0 -8.3 1.253 -1.623
24 C58 C C58 N N N 0 -7.943 2.553 -0.899
25 C6 C C6 N N N 0 5.474 0.273 -2.069
26 C62 C C62 N N N 0 -7.775 1.309 -3.059
27 C66 C C66 N N N 0 -9.82 1.081 -1.642
28 C72 C C72 N N N 0 5.64 -0.784 0.203
29 C75 C C75 N N N 0 6.972 -1.423 -0.198
30 C9 C C9 N N N 0 5.445 0.516 -0.565
31 F1 F F1 N N N 0 5.915 -2.549 -2.026
32 F23 F F23 N N N 0 3.742 4.042 2.06
33 F78 F F78 N N N 0 8.184 -2.289 -2.07
34 H1 H H1 N N N 0 7.625 0.3 -2.201
35 H10 H H10 N N N 0 -0.174 2.377 -0.317
36 H11 H H11 N N N 0 0.35 1.017 -1.339
37 H12 H H12 N N N 0 -0.084 0.851 1.675
38 H13 H H13 N N N 0 -1.811 -0.268 -0.565
39 H14 H H14 N N N 0 -2.118 -0.044 2.453
40 H15 H H15 N N N 0 -2.449 -2.515 2.245
41 H16 H H16 N N N 0 -2.109 -2.39 0.5
42 H17 H H17 N N N 0 0.336 -1.31 -0.439
43 H18 H H18 N N N 0 1.583 -0.74 0.699
44 H19 H H19 N N N 0 -4.311 -0.849 2.099
45 H2 H H2 N N N 0 6.818 -0.563 -3.532
46 H21 H H21 N N N 0 -3.747 -0.617 -0.785
47 H22 H H22 N N N 0 -3.911 -2.158 0.091
48 H23 H H23 N N N 0 -5.675 0.809 -1.162
49 H24 H H24 N N N 0 -9.541 -0.865 -0.498
50 H25 H H25 N N N 0 -8.515 -2.769 0.68
51 H26 H H26 N N N 0 -6.068 -2.889 0.927
52 H27 H H27 N N N 0 -6.86 2.676 -0.885
53 H28 H H28 N N N 0 -8.398 3.396 -1.42
54 H29 H H29 N N N 0 -8.317 2.514 0.124
55 H3 H H3 N N N 0 5.364 1.223 -2.592
56 H30 H H30 N N N 0 -8.029 0.383 -3.575
57 H31 H H31 N N N 0 -8.229 2.151 -3.58
58 H32 H H32 N N N 0 -6.692 1.431 -3.045
59 H33 H H33 N N N 0 -10.194 1.042 -0.619
60 H34 H H34 N N N 0 -10.275 1.924 -2.163
61 H35 H H35 N N N 0 -10.074 0.155 -2.158
62 H36 H H36 N N N 0 -3.234 1.531 -0.034
63 H37 H H37 N N N 0 5.645 -0.576 1.273
64 H38 H H38 N N N 0 4.824 -1.469 -0.029
65 H39 H H39 N N N 0 7.1 -2.363 0.339
66 H4 H H4 N N N 0 4.655 -0.39 -2.345
67 H40 H H40 N N N 0 7.789 -0.747 0.052
68 H5 H H5 N N N 0 7.417 1.038 0.205
69 H6 H H6 N N N 0 6.767 2.193 -1.006
70 H7 H H7 N N N 0 6.108 1.934 1.821
71 H8 H H8 N N N 0 2.6 0.124 -1.16
72 H9 H H9 N N N 0 1.345 3.382 1.287
73 N13 N N13 N N N 0 5.86 2.302 0.915
74 N42 N N42 N N N 0 -3.832 -0.447 1.308
75 O40 O O40 N N N 0 0.108 -1.438 3.101
76 O41 O O41 N N N 0 0.344 -3.324 1.551
77 O70 O O70 N N N 0 -2.308 1.564 0.245
78 S36 S S36 N N N 0 -0.129 -2.012 1.822