Chemical Components in the PDB

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PDBeChem : Atoms of Molecule

 Molecule : MBX

Atoms of a chemical element, that composes a molecule

Total Number of Atoms: 70


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 -4.139 -4.35 -0.336
2 C1 C C1 N N N 0 -3.737 -3.288 -0.296
3 C2 C C2 N Y N 0 -3.23 -1.95 -0.245
4 C7 C C3 N Y N 0 -1.849 -1.712 -0.118
5 N6 N N2 N Y N 0 -1.386 -0.473 -0.073
6 C5 C C4 N Y N 0 -2.193 0.575 -0.142
7 N17 N N3 N N N 0 -1.657 1.851 -0.085
8 C22 C C5 N N N 0 -0.265 1.86 -0.557
9 C21 C C6 S N N 0 0.267 3.296 -0.533
10 O20 O O1 N N N 0 0.14 3.825 0.789
11 C19 C C7 S N N 0 -1.203 3.832 1.28
12 C18 C C8 N N N 0 -1.75 2.402 1.275
13 C4 C C9 N Y N 0 -3.575 0.415 -0.266
14 C8 C C10 N N N 0 -4.455 1.635 -0.329
15 O8 O O2 N N N 0 -5.749 1.284 -0.818
16 C30 C C11 N N N 0 -6.344 0.189 -0.113
17 C6 C C12 N N N 0 -5.581 -1.089 -0.467
18 C3 C C13 N Y N 0 -4.101 -0.853 -0.327
19 S8 S S1 N N N 0 -0.731 -3.071 -0.018
20 C9 C C14 N N N 0 0.836 -2.178 0.127
21 C10 C C15 N N N 0 1.987 -3.181 0.231
22 C11 C C16 N Y N 0 3.292 -2.437 0.352
23 C16 C C17 N Y N 0 3.78 -2.099 1.6
24 C15 C C18 N Y N 0 4.976 -1.417 1.715
25 C14 C C19 N Y N 0 5.688 -1.071 0.573
26 C25 C C24 N N N 0 -6.255 0.44 1.394
27 C13 C C20 N Y N 0 5.196 -1.413 -0.679
28 C12 C C21 N Y N 0 4.002 -2.099 -0.786
29 C17 C C22 N N N 0 -2.071 4.713 0.38
30 C24 C C23 N N N 0 1.74 3.301 -0.947
31 C26 C C25 N N N 0 -7.811 0.048 -0.525
32 N27 N N4 N N N 0 6.899 -0.38 0.686
33 C28 C C26 N N N 0 7.244 0.531 -0.245
34 O30 O O3 N N N 0 6.459 0.826 -1.127
35 C20 C C27 N N N 0 8.568 1.169 -0.195
36 C23 C C28 N N N 0 8.908 2.069 -1.114
37 H1 H H1 N N N 0 0.345 1.236 0.097
38 H2 H H2 N N N 0 -0.223 1.472 -1.574
39 H3 H H3 N N N 0 -0.308 3.908 -1.227
40 H4 H H4 N N N 0 -1.217 4.223 2.297
41 H5 H H5 N N N 0 -2.793 2.409 1.594
42 H6 H H6 N N N 0 -1.165 1.786 1.958
43 H7 H H7 N N N 0 -4.55 2.063 0.669
44 H8 H H8 N N N 0 -4.004 2.371 -0.994
45 H9 H H9 N N N 0 -5.887 -1.892 0.203
46 H13 H H13 N N N 0 1.844 -3.808 1.11
47 H10 H H10 N N N 0 -5.802 -1.37 -1.497
48 H11 H H11 N N N 0 0.98 -1.55 -0.752
49 H12 H H12 N N N 0 0.817 -1.553 1.02
50 H14 H H14 N N N 0 2.006 -3.805 -0.663
51 H15 H H15 N N N 0 3.226 -2.368 2.487
52 H16 H H16 N N N 0 5.356 -1.152 2.69
53 H17 H H17 N N N 0 5.747 -1.145 -1.569
54 H18 H H18 N N N 0 3.618 -2.365 -1.76
55 H19 H H19 N N N 0 -2.058 4.32 -0.637
56 H20 H H20 N N N 0 -3.095 4.718 0.754
57 H21 H H21 N N N 0 -1.679 5.731 0.381
58 H22 H H22 N N N 0 1.836 2.895 -1.954
59 H23 H H23 N N N 0 2.118 4.324 -0.931
60 H24 H H24 N N N 0 2.315 2.69 -0.252
61 H25 H H25 N N N 0 -6.785 1.36 1.641
62 H26 H H26 N N N 0 -6.708 -0.395 1.928
63 H27 H H27 N N N 0 -5.209 0.533 1.686
64 H28 H H28 N N N 0 -7.871 -0.137 -1.597
65 H29 H H29 N N N 0 -8.26 -0.786 0.014
66 H30 H H30 N N N 0 -8.346 0.967 -0.284
67 H31 H H31 N N N 0 7.491 -0.557 1.434
68 H32 H H32 N N N 0 9.264 0.907 0.587
69 H33 H H33 N N N 0 8.211 2.331 -1.897
70 H34 H H34 N N N 0 9.88 2.538 -1.077