Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : AAQ

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 48


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 -3.543 2.506 -0.191
2 C3 C C3 N Y N 0 -3.151 1.176 -0.096
3 C2 C C2 N Y N 0 -3.798 -0.022 -0.316
4 C4 C C4 N Y N 0 -3.11 -1.219 -0.128
5 C5 C C5 N Y N 0 -1.755 -1.21 0.285
6 C6 C C6 N Y N 0 -1.109 0.001 0.505
7 C7 C C7 N N N 0 0.333 0.022 0.945
8 C8 C C8 N N N 0 1.241 0.056 -0.286
9 N2 N N2 N N N 0 2.646 0.076 0.143
10 C9 C C9 N N N 0 3.549 0.108 -1.015
11 C10 C C10 N Y N 0 4.978 0.128 -0.537
12 C11 C C11 N Y N 0 5.656 -1.059 -0.334
13 C12 C C12 N Y N 0 6.966 -1.041 0.105
14 C13 C C13 N Y N 0 7.6 0.166 0.34
15 C14 C C14 N Y N 0 6.922 1.353 0.135
16 C15 C C15 N Y N 0 5.613 1.335 -0.308
17 C16 C C16 N Y N 0 -1.801 1.196 0.316
18 N3 N N3 N Y N 0 -1.446 2.5 0.449
19 C17 C C17 N Y N 0 -2.465 3.269 0.152
20 N4 N N4 N N N 0 -2.45 4.646 0.181
21 C1 C C1 N N N 0 -3.655 5.399 -0.174
22 N5 N N5 N N N 0 -1.111 -2.393 0.46
23 C18 C C18 N N N 0 -1.713 -3.536 0.256
24 N6 N N6 N N N 0 -1.002 -4.694 0.452
25 N7 N N7 N N N 0 -3.015 -3.631 -0.144
26 C19 C C19 N N N 0 -3.756 -2.519 -0.35
27 O1 O O1 N N N 0 -4.918 -2.592 -0.705
28 HN1 H HN1 N N N 0 -4.418 2.831 -0.456
29 H2 H H2 N N N 0 -4.831 -0.032 -0.631
30 H7 H H7 N N N 0 0.514 0.908 1.554
31 H7A H H7A N N N 0 0.547 -0.872 1.531
32 H8 H H8 N N N 0 1.06 -0.83 -0.895
33 H8A H H8A N N N 0 1.026 0.949 -0.872
34 HN2 H HN2 N N N 0 2.824 0.853 0.762
35 H9 H H9 N N N 0 3.384 -0.777 -1.629
36 H9A H H9A N N N 0 3.351 1.002 -1.606
37 H11 H H11 N N N 0 5.161 -2.001 -0.517
38 H12 H H12 N N N 0 7.496 -1.968 0.264
39 H13 H H13 N N N 0 8.624 0.18 0.683
40 H14 H H14 N N N 0 7.417 2.296 0.319
41 H15 H H15 N N N 0 5.085 2.263 -0.471
42 HN4 H HN4 N N N 0 -1.641 5.116 0.436
43 H1 H H1 N N N 0 -3.452 6.467 -0.093
44 H1A H H1A N N N 0 -3.944 5.161 -1.198
45 H1B H H1B N N N 0 -4.464 5.13 0.504
46 HN6 H HN6 N N N 0 -0.075 -4.652 0.736
47 HN6A H HN6A N N N 0 -1.426 -5.554 0.307
48 HN7 H HN7 N N N 0 -3.412 -4.505 -0.281