Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KJ1

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 55


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 C13 C C1 N N N 0 2.022 -0.312 0.0
2 C15 C C2 N N N 0 4.521 -0.296 0.0
3 C17 C C3 N N N 0 7.019 -0.281 0.0
4 C01 C C4 N N N 0 -11.626 0.219 0.0
5 C02 C C5 N N N 0 -10.371 -0.656 0.0
6 C03 C C6 N N N 0 -9.127 0.235 0.0
7 C04 C C7 N N N 0 -7.873 -0.641 0.0
8 C05 C C8 N N N 0 -6.629 0.25 0.0
9 C06 C C9 N N N 0 -5.374 -0.626 0.0
10 C07 C C10 N N N 0 -4.13 0.265 0.0
11 C08 C C11 N N N 0 -2.876 -0.61 0.0
12 C09 C C12 N N N 0 -1.651 0.267 0.0
13 O10 O O1 N N N 0 -1.77 1.474 0.0
14 N11 N N1 N N N 0 -0.423 -0.289 0.0
15 C12 C C13 N N N 0 0.768 0.564 0.0
16 C14 C C14 N N N 0 3.266 0.579 0.0
17 C16 C C15 N N N 0 5.765 0.595 0.0
18 C18 C C16 N N N 0 8.263 0.61 0.0
19 C19 C C17 N N N 0 9.499 -0.252 0.0
20 N20 N N2 N N N 0 10.719 0.319 0.0
21 O21 O O2 N N N 0 9.395 -1.461 0.0
22 H1 H H1 N N N 0 2.026 -0.941 0.89
23 H2 H H2 N N N 0 2.026 -0.941 -0.89
24 H3 H H3 N N N 0 4.525 -0.926 0.89
25 H4 H H4 N N N 0 4.525 -0.926 -0.89
26 H5 H H5 N N N 0 7.023 -0.91 0.89
27 H6 H H6 N N N 0 -11.63 0.849 -0.89
28 H7 H H7 N N N 0 -12.512 -0.415 0.0
29 H8 H H8 N N N 0 -11.63 0.849 0.89
30 H9 H H9 N N N 0 -10.367 -1.286 0.89
31 H10 H H10 N N N 0 -10.367 -1.286 -0.89
32 H11 H H11 N N N 0 -9.131 0.864 -0.89
33 H12 H H12 N N N 0 -9.131 0.864 0.89
34 H13 H H13 N N N 0 -7.869 -1.27 0.89
35 H14 H H14 N N N 0 -7.869 -1.27 -0.89
36 H15 H H15 N N N 0 -6.633 0.879 -0.89
37 H16 H H16 N N N 0 -6.633 0.879 0.89
38 H17 H H17 N N N 0 -5.371 -1.255 0.89
39 H18 H H18 N N N 0 -5.371 -1.255 -0.89
40 H19 H H19 N N N 0 -4.134 0.895 -0.89
41 H20 H H20 N N N 0 -4.134 0.895 0.89
42 H21 H H21 N N N 0 -2.872 -1.24 0.89
43 H22 H H22 N N N 0 -2.872 -1.24 -0.89
44 H23 H H23 N N N 0 -0.328 -1.254 0.0
45 H24 H H24 N N N 0 0.764 1.193 0.89
46 H25 H H25 N N N 0 0.764 1.193 -0.89
47 H26 H H26 N N N 0 3.262 1.209 -0.89
48 H27 H H27 N N N 0 3.262 1.209 0.89
49 H28 H H28 N N N 0 5.761 1.224 -0.89
50 H29 H H29 N N N 0 8.259 1.239 -0.89
51 H30 H H30 N N N 0 8.259 1.239 0.89
52 H31 H H31 N N N 0 11.515 -0.236 0.0
53 H32 H H32 N N N 0 10.802 1.285 0.0
54 H34 H H34 N N N 0 5.761 1.224 0.89
55 H33 H H33 N N N 0 7.023 -0.91 -0.89