Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 4R6

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 42


Record Atom Name Symbol PDB Name Stereochemistry Is Aromatic Is Leaving Atom Charge X-Coordinate Y-Coordinate Z-Coordinate
1 N1 N N1 N N N 0 2.162 1.761 -0.044
2 C4 C C1 N Y N 0 -2.217 4.275 -0.356
3 C5 C C2 N Y N 0 -0.89 4.672 -0.368
4 C6 C C3 N Y N 0 0.117 3.736 -0.264
5 C7 C C4 N N N 0 0.871 1.374 -0.033
6 C8 C C5 N Y N 0 3.176 0.818 0.154
7 C10 C C6 N Y N 0 4.036 -1.401 -0.141
8 C13 C C7 N Y N 0 4.326 1.169 0.848
9 C15 C C8 N Y N 0 -3.42 -1.151 0.119
10 C17 C C9 N Y N 0 -3.499 -2.114 -0.914
11 C1 C C10 N Y N 0 -0.202 2.381 -0.145
12 C11 C C11 N Y N 0 5.183 -1.046 0.547
13 C12 C C12 N Y N 0 5.326 0.236 1.043
14 C14 C C13 N N N 0 -3.258 0.341 -0.015
15 C16 C C14 N Y N 0 -3.529 -1.88 1.255
16 C18 C C15 N N N 0 -3.433 -1.855 -2.397
17 C19 C C16 N N N 0 -3.512 -1.357 2.668
18 C2 C C17 N Y N 0 -1.546 1.984 -0.134
19 C3 C C18 N Y N 0 -2.546 2.939 -0.234
20 C9 C C19 N Y N 0 3.032 -0.472 -0.339
21 N2 N N2 N Y N 0 -3.641 -3.269 -0.329
22 O1 O O1 N N N 0 -1.867 0.67 -0.02
23 O2 O O2 N N N 0 0.59 0.196 0.07
24 O3 O O3 N Y N 0 -3.655 -3.159 0.875
25 CL1 CL CL1 N N N 0 3.857 -3.015 -0.756
26 H1 H H1 N N N 0 2.388 2.692 -0.194
27 H2 H H2 N N N 0 -2.999 5.015 -0.438
28 H3 H H3 N N N 0 -0.643 5.719 -0.46
29 H4 H H4 N N N 0 1.15 4.05 -0.274
30 H5 H H5 N N N 0 4.439 2.171 1.236
31 H6 H H6 N N N 0 5.966 -1.774 0.7
32 H7 H H7 N N N 0 6.221 0.509 1.582
33 H8 H H8 N N N 0 -3.713 0.674 -0.947
34 H9 H H9 N N N 0 -3.746 0.836 0.825
35 H10 H H10 N N N 0 -2.396 -1.905 -2.728
36 H11 H H11 N N N 0 -4.019 -2.608 -2.924
37 H12 H H12 N N N 0 -3.836 -0.865 -2.611
38 H13 H H13 N N N 0 -4.53 -1.122 2.98
39 H14 H H14 N N N 0 -3.094 -2.114 3.331
40 H15 H H15 N N N 0 -2.901 -0.455 2.714
41 H16 H H16 N N N 0 -3.583 2.638 -0.225
42 H17 H H17 N N N 0 2.136 -0.75 -0.875