Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : KR4

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 44


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 -1.035 -2.138 0.063
2 C5 C C2 N Y N 0 1.363 -2.104 -0.152
3 C6 C C3 N Y N 0 1.551 -0.974 0.633
4 C7 C C4 N Y N 0 2.741 -0.278 0.565
5 C8 C C5 N Y N 0 3.745 -0.704 -0.285
6 C10 C C6 N Y N 0 2.374 -2.53 -1.004
7 C9 C C7 N Y N 0 3.562 -1.828 -1.068
8 C12 C C8 N N N 0 6.025 -0.505 0.671
9 C11 C C9 N N N 0 5.043 0.059 -0.358
10 C18 C C10 N Y N 0 -1.062 2.036 -0.09
11 C3 C C11 N Y N 0 -2.21 -0.164 0.149
12 C2 C C12 N Y N 0 -3.311 -2.169 0.375
13 C1 C C13 N N N 0 -4.59 -2.94 0.579
14 CL CL CL1 N N N 0 0.371 4.313 -0.372
15 C17 C C14 N Y N 0 -1.097 3.416 -0.138
16 C16 C C15 N Y N 0 -2.3 4.085 0.001
17 C15 C C16 N Y N 0 -3.474 3.376 0.189
18 C14 C C17 N Y N 0 -3.45 1.998 0.237
19 C13 C C18 N Y N 0 -2.241 1.318 0.098
20 N N N1 N Y N 0 -3.338 -0.848 0.329
21 N1 N N2 N Y N 0 -1.057 -0.81 0.016
22 N2 N N3 N Y N 0 -2.166 -2.815 0.243
23 C C C19 N N N 0 -5.218 -3.254 -0.78
24 N3 N N4 N N N 0 0.161 -2.815 -0.081
25 O O O1 N N N 0 7.255 0.219 0.602
26 H1 H H1 N N N 0 0.766 -0.641 1.297
27 H2 H H2 N N N 0 2.888 0.601 1.176
28 H3 H H3 N N N 0 2.232 -3.411 -1.613
29 H4 H H4 N N N 0 4.348 -2.158 -1.731
30 H5 H H5 N N N 0 5.601 -0.405 1.671
31 H6 H H6 N N N 0 6.21 -1.557 0.458
32 H7 H H7 N N N 0 5.467 -0.04 -1.357
33 H8 H H8 N N N 0 4.858 1.112 -0.144
34 H9 H H9 N N N 0 -0.123 1.514 -0.203
35 H10 H H10 N N N 0 -4.373 -3.87 1.103
36 H11 H H11 N N N 0 -5.284 -2.342 1.17
37 H12 H H12 N N N 0 -2.324 5.164 -0.037
38 H13 H H13 N N N 0 -4.41 3.904 0.297
39 H14 H H14 N N N 0 -4.367 1.446 0.384
40 H15 H H15 N N N 0 -6.143 -3.812 -0.633
41 H16 H H16 N N N 0 -5.435 -2.324 -1.305
42 H17 H H17 N N N 0 -4.524 -3.852 -1.372
43 H18 H H18 N N N 0 0.166 -3.784 -0.132
44 H19 H H19 N N N 0 7.926 -0.085 1.229