![spacer](http://www.ebi.ac.uk/inc/images/spacer.gif) |
PDBeChem : Atoms of Molecule
Molecule : 3LU
Atoms of a chemical element, that composes a molecule
Total Number of Atoms: 56
Record |
Atom Name |
Symbol |
PDB Name |
Stereochemistry |
Is Aromatic |
Is Leaving Atom |
Charge |
X-Coordinate |
Y-Coordinate |
Z-Coordinate |
1 |
S1 |
S |
S1 |
N |
N |
N |
0 |
4.324 |
-1.932 |
-0.024 |
2 |
C1 |
C |
C1 |
N |
Y |
N |
0 |
6.813 |
1.956 |
-1.639 |
3 |
C2 |
C |
C2 |
N |
Y |
N |
0 |
7.371 |
2.224 |
-0.403 |
4 |
C3 |
C |
C3 |
N |
Y |
N |
0 |
6.819 |
1.674 |
0.739 |
5 |
C4 |
C |
C4 |
N |
Y |
N |
0 |
5.145 |
0.596 |
-0.59 |
6 |
C5 |
C |
C5 |
R |
N |
N |
0 |
3.932 |
-0.292 |
-0.692 |
7 |
C6 |
C |
C6 |
N |
N |
N |
0 |
2.798 |
0.314 |
0.095 |
8 |
C7 |
C |
C7 |
R |
N |
N |
0 |
-0.8 |
0.852 |
-0.428 |
9 |
C8 |
C |
C8 |
N |
N |
N |
0 |
-4.189 |
2.288 |
0.494 |
10 |
C9 |
C |
C9 |
N |
N |
N |
0 |
-2.86 |
-0.332 |
-1.937 |
11 |
C10 |
C |
C10 |
N |
N |
N |
0 |
-3.67 |
0.637 |
-1.126 |
12 |
C11 |
C |
C11 |
N |
Y |
N |
0 |
5.7 |
1.142 |
-1.732 |
13 |
N1 |
N |
N1 |
N |
N |
N |
0 |
1.523 |
0.101 |
-0.287 |
14 |
O1 |
O |
O1 |
N |
N |
N |
0 |
4.715 |
-1.668 |
1.423 |
15 |
N3 |
N |
N3 |
N |
N |
N |
0 |
-1.912 |
1.442 |
0.331 |
16 |
O2 |
O |
O2 |
N |
N |
N |
0 |
3.15 |
-2.727 |
0.07 |
17 |
S2 |
S |
S2 |
N |
N |
N |
0 |
-1.357 |
-0.781 |
-1.016 |
18 |
O3 |
O |
O3 |
N |
N |
N |
0 |
5.509 |
-2.443 |
-0.619 |
19 |
O4 |
O |
O4 |
N |
N |
N |
0 |
3.034 |
0.992 |
1.072 |
20 |
C12 |
C |
C12 |
N |
Y |
N |
0 |
5.71 |
0.855 |
0.645 |
21 |
O5 |
O |
O5 |
N |
N |
N |
0 |
-0.913 |
0.127 |
2.477 |
22 |
O6 |
O |
O6 |
N |
N |
N |
0 |
0.684 |
-1.243 |
1.801 |
23 |
O7 |
O |
O7 |
N |
N |
N |
0 |
-4.628 |
2.014 |
1.594 |
24 |
O8 |
O |
O8 |
N |
N |
N |
0 |
-4.594 |
3.41 |
-0.132 |
25 |
C13 |
C |
C13 |
R |
N |
N |
0 |
0.422 |
0.69 |
0.478 |
26 |
C14 |
C |
C14 |
N |
N |
N |
0 |
0.074 |
-0.213 |
1.634 |
27 |
C15 |
C |
C15 |
N |
N |
N |
0 |
-3.213 |
1.393 |
-0.154 |
28 |
C16 |
C |
C16 |
N |
N |
N |
0 |
-5.136 |
0.754 |
-1.456 |
29 |
H1 |
H |
H1 |
N |
N |
N |
0 |
7.245 |
2.386 |
-2.53 |
30 |
H2 |
H |
H2 |
N |
N |
N |
0 |
8.238 |
2.864 |
-0.329 |
31 |
H3 |
H |
H3 |
N |
N |
N |
0 |
7.256 |
1.883 |
1.705 |
32 |
H4 |
H |
H4 |
N |
N |
N |
0 |
3.638 |
-0.387 |
-1.738 |
33 |
H5 |
H |
H5 |
N |
N |
N |
0 |
-0.55 |
1.488 |
-1.277 |
34 |
H6 |
H |
H6 |
N |
N |
N |
0 |
-3.45 |
-1.228 |
-2.128 |
35 |
H7 |
H |
H7 |
N |
N |
N |
0 |
-2.582 |
0.13 |
-2.884 |
36 |
H9 |
H |
H9 |
N |
N |
N |
0 |
5.259 |
0.939 |
-2.697 |
37 |
H10 |
H |
H10 |
N |
N |
N |
0 |
1.335 |
-0.441 |
-1.069 |
38 |
H11 |
H |
H11 |
N |
N |
N |
0 |
5.276 |
0.428 |
1.537 |
39 |
H12 |
H |
H12 |
N |
N |
N |
0 |
-1.1 |
-0.484 |
3.203 |
40 |
H13 |
H |
H13 |
N |
N |
N |
0 |
-5.234 |
3.966 |
0.332 |
41 |
H14 |
H |
H14 |
N |
N |
N |
0 |
0.724 |
1.666 |
0.858 |
42 |
H15 |
H |
H15 |
N |
N |
N |
0 |
-5.276 |
0.646 |
-2.532 |
43 |
N2 |
N |
N2 |
N |
Y |
N |
1 |
-5.879 |
-0.299 |
-0.759 |
44 |
H17 |
H |
H17 |
N |
N |
N |
0 |
-5.503 |
1.73 |
-1.138 |
45 |
H8 |
H |
H8 |
N |
N |
N |
0 |
4.955 |
-2.464 |
1.917 |
46 |
C19 |
C |
C19 |
N |
Y |
N |
0 |
-6.461 |
-0.02 |
0.391 |
47 |
C17 |
C |
C17 |
N |
Y |
N |
0 |
-7.171 |
-0.987 |
1.077 |
48 |
C20 |
C |
C20 |
N |
Y |
N |
0 |
-7.266 |
-2.263 |
0.541 |
49 |
C21 |
C |
C21 |
N |
Y |
N |
0 |
-6.641 |
-2.518 |
-0.67 |
50 |
C22 |
C |
C22 |
N |
Y |
N |
0 |
-5.952 |
-1.499 |
-1.301 |
51 |
H16 |
H |
H16 |
N |
N |
N |
0 |
-6.383 |
0.976 |
0.801 |
52 |
H18 |
H |
H18 |
N |
N |
N |
0 |
-7.645 |
-0.753 |
2.018 |
53 |
H19 |
H |
H19 |
N |
N |
N |
0 |
-7.813 |
-3.039 |
1.055 |
54 |
H20 |
H |
H20 |
N |
N |
N |
0 |
-6.693 |
-3.5 |
-1.116 |
55 |
H21 |
H |
H21 |
N |
N |
N |
0 |
-5.463 |
-1.689 |
-2.244 |
56 |
H22 |
H |
H22 |
N |
N |
N |
0 |
-1.735 |
1.872 |
1.182 |
|