Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : 97U

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 CD1 C C1 N Y N 0 -5.028 -1.079 -1.355
2 CE1 C C2 N Y N 0 -4.947 -2.133 -2.245
3 CG C C6 N Y N 0 -4.254 -1.081 -0.209
4 CZ C C3 N Y N 0 -4.097 -3.193 -1.987
5 CE2 C C4 N Y N 0 -3.328 -3.197 -0.839
6 CD2 C C5 N Y N 0 -3.408 -2.143 0.052
7 CB C C7 N N N 0 -4.341 0.069 0.761
8 CA C C8 S N N 0 -3.307 1.132 0.387
9 C C C9 N N N 0 -3.476 2.334 1.28
10 O O O1 N N N 0 -2.565 2.695 1.986
11 OXT O O2 N N N 0 -4.64 3.003 1.291
12 N N N1 N N N 0 -1.959 0.584 0.556
13 CAN C C10 N N N 0 -0.931 1.092 -0.151
14 OAX O O3 N N N 0 -1.122 2.007 -0.929
15 CAA C C11 N Y N 0 0.426 0.54 0.02
16 CAB C C12 N Y N 0 0.649 -0.514 0.909
17 CAG C C15 N N N 0 4.356 -1.123 0.528
18 CAC C C13 N Y N 0 1.916 -1.039 1.067
19 CLA CL CL1 N N N 0 2.173 -2.349 2.178
20 CAD C C14 N Y N 0 2.983 -0.53 0.348
21 CAH C C16 R N N 0 5.427 -0.128 0.081
22 CAL C C17 N N N 0 6.786 -0.828 0.031
23 OAI O O4 N N N 0 5.091 0.377 -1.244
24 CAJ C C18 N N N 0 3.924 1.069 -1.302
25 OAK O O5 N N N 0 3.826 2.092 -1.951
26 CAE C C19 N Y N 0 2.778 0.526 -0.543
27 CAF C C20 N Y N 0 1.499 1.066 -0.713
28 OBB O O6 N N N 0 1.298 2.084 -1.582
29 HD1 H H1 N N N 0 -5.692 -0.251 -1.557
30 HE1 H H2 N N N 0 -5.549 -2.13 -3.142
31 HZ H H3 N N N 0 -4.035 -4.016 -2.682
32 HE2 H H4 N N N 0 -2.664 -4.025 -0.637
33 HD2 H H5 N N N 0 -2.807 -2.147 0.949
34 HB1 H H6 N N N 0 -5.34 0.503 0.72
35 HB2 H H7 N N N 0 -4.143 -0.292 1.77
36 HAM H H8 N N N 0 -3.451 1.429 -0.652
37 H1 H H9 N N N 0 -4.701 3.768 1.88
38 H H H10 N N N 0 -1.807 -0.146 1.177
39 HAB H H11 N N N 0 -0.175 -0.921 1.476
40 HAG H H12 N N N 0 4.508 -1.369 1.579
41 HAH H H13 N N N 0 4.437 -2.033 -0.067
42 HAI H H14 N N N 0 5.47 0.702 0.786
43 HA1 H H15 N N N 0 6.742 -1.657 -0.676
44 HA2 H H16 N N N 0 7.549 -0.118 -0.288
45 HA3 H H17 N N N 0 7.036 -1.209 1.021
46 H2 H H18 N N N 0 1.395 2.963 -1.189