Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : QRC

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 46


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C18 C C1 N Y N 0 -5.186 1.348 0.703
2 C16 C C2 N N N 0 -4.705 -0.947 -0.501
3 C17 C C3 N Y N 0 -4.398 0.45 -0.006
4 C13 C C4 N N N 0 -2.8 -2.32 0.389
5 C12 C C5 S N N 0 -3.331 -1.577 -0.811
6 C11 C C6 S N N 0 -2.461 -0.34 -1.119
7 C20 C C7 N Y N 0 -4.681 2.591 1.053
8 C01 C C8 N N N 0 8.38 1.113 0.737
9 C03 C C9 N N N 0 6.115 0.252 0.484
10 C05 C C10 N Y N 0 3.91 -0.545 0.111
11 C06 C C11 N Y N 0 3.671 0.296 -0.972
12 C07 C C12 N Y N 0 2.385 0.497 -1.418
13 C08 C C13 N Y N 0 1.318 -0.145 -0.783
14 C09 C C14 N N N 0 -0.063 0.068 -1.26
15 C21 C C15 N Y N 0 -3.392 2.935 0.696
16 C22 C C16 N Y N 0 -2.608 2.041 -0.009
17 C23 C C17 N Y N 0 -3.109 0.799 -0.361
18 C25 C C18 N Y N 0 1.561 -0.989 0.304
19 C26 C C19 N Y N 0 2.851 -1.19 0.742
20 N02 N N1 N N N 0 7.401 0.027 0.821
21 N04 N N2 N N N 0 5.214 -0.747 0.561
22 N10 N N3 N N N 0 -1.091 -0.552 -0.646
23 O14 O O1 N N N 0 -3.031 -1.912 1.502
24 O15 O O2 N N N 0 -2.071 -3.434 0.219
25 O19 O O3 N N N 0 -6.456 1.01 1.048
26 O24 O O4 N N N 0 -0.273 0.802 -2.206
27 O27 O O5 N N N 0 5.769 1.356 0.11
28 H161 H H1 N N N 0 -5.218 -1.518 0.273
29 H162 H H2 N N N 0 -5.314 -0.904 -1.405
30 H121 H H3 N N N 0 -3.393 -2.237 -1.676
31 H111 H H4 N N N 0 -2.463 -0.133 -2.189
32 H201 H H5 N N N 0 -5.295 3.289 1.603
33 H011 H H6 N N N 0 8.437 1.474 -0.29
34 H012 H H7 N N N 0 8.075 1.929 1.392
35 H013 H H8 N N N 0 9.358 0.745 1.047
36 H061 H H9 N N N 0 4.496 0.791 -1.462
37 H071 H H10 N N N 0 2.2 1.15 -2.258
38 H211 H H11 N N N 0 -2.997 3.903 0.967
39 H221 H H12 N N N 0 -1.601 2.313 -0.287
40 H251 H H13 N N N 0 0.739 -1.486 0.797
41 H261 H H14 N N N 0 3.04 -1.846 1.579
42 H021 H H15 N N N 0 7.677 -0.853 1.118
43 H041 H H16 N N N 0 5.473 -1.606 0.929
44 H101 H H17 N N N 0 -0.923 -1.137 0.109
45 H1 H H18 N N N 0 -1.752 -3.876 1.018
46 H191 H H19 N N N 0 -6.527 0.574 1.908