Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : NQF

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 54


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 -1.996 0.525 -0.619
2 N3 N N1 N N N 0 -8.458 -1.817 0.308
3 C2 C C2 N N N 0 0.324 1.283 -0.513
4 N1 N N2 N Y N 0 -3.514 1.017 1.098
5 C7 C C3 N N N 0 -6.886 -0.128 0.993
6 C6 C C4 N Y N 0 -4.517 0.38 0.47
7 O2 O O1 N N N 0 -7.663 0.028 1.912
8 C5 C C5 N Y N 0 -2.302 1.109 0.614
9 C1 C C6 N N N 0 1.669 1.383 -1.078
10 C10 C C7 N N N 0 -5.286 -0.985 -1.549
11 C11 C C8 N Y N 0 -4.278 -0.228 -0.749
12 C12 C C9 N Y N 0 -3.012 -0.153 -1.3
13 C13 C C10 N N N 0 2.311 2.752 0.833
14 C14 C C11 N N N 0 4.009 2.044 -0.915
15 C15 C C12 N Y N 0 4.723 0.805 -0.442
16 C16 C C13 N Y N 0 5.34 0.679 0.741
17 C17 C C14 N N N 0 5.447 1.725 1.821
18 C18 C C15 N Y N 0 5.889 -0.681 0.774
19 C20 C C17 N Y N 0 6.992 -2.709 1.416
20 C19 C C16 N Y N 0 6.623 -1.413 1.706
21 C21 C C18 N Y N 0 6.636 -3.282 0.204
22 C22 C C19 N Y N 0 5.91 -2.569 -0.726
23 C23 C C20 N Y N 0 5.528 -1.262 -0.454
24 C3 C C21 N N N 0 -0.643 0.625 -1.186
25 C8 C C22 R N N 0 -7.377 -0.936 -0.155
26 C9 C C23 N N N 0 -6.279 -1.78 -0.759
27 N2 N N3 N N N 0 -5.718 0.431 1.124
28 N4 N N4 N N N 0 2.635 2.041 -0.406
29 O1 O O2 N N N 0 1.917 0.873 -2.155
30 O3 O O3 N Y N 0 4.829 -0.338 -1.143
31 H1 H H1 N N N 0 -9.226 -1.281 0.683
32 H2 H H2 N N N 0 -8.77 -2.426 -0.434
33 H4 H H4 N N N 0 0.104 1.736 0.442
34 H5 H H5 N N N 0 -1.538 1.636 1.168
35 H6 H H6 N N N 0 -5.832 -0.274 -2.168
36 H7 H H7 N N N 0 -4.75 -1.668 -2.208
37 H8 H H8 N N N 0 -2.809 -0.615 -2.255
38 H9 H H9 N N N 0 2.433 2.078 1.681
39 H10 H H10 N N N 0 2.98 3.605 0.948
40 H11 H H11 N N N 0 1.28 3.101 0.792
41 H12 H H12 N N N 0 4.531 2.928 -0.546
42 H13 H H13 N N N 0 3.993 2.06 -2.005
43 H14 H H14 N N N 0 4.556 1.692 2.448
44 H15 H H15 N N N 0 6.328 1.528 2.432
45 H16 H H16 N N N 0 5.534 2.711 1.365
46 H17 H H17 N N N 0 6.901 -0.968 2.65
47 H18 H H18 N N N 0 7.561 -3.28 2.134
48 H19 H H19 N N N 0 6.931 -4.298 -0.014
49 H21 H H21 N N N 0 -0.424 0.172 -2.142
50 H20 H H20 N N N 0 5.639 -3.026 -1.666
51 H22 H H22 N N N 0 -7.769 -0.265 -0.919
52 H23 H H23 N N N 0 -6.732 -2.524 -1.414
53 H24 H H24 N N N 0 -5.754 -2.297 0.044
54 H25 H H25 N N N 0 -5.692 1.04 1.878