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PDBeChem : Atoms of Molecule
Molecule : CAS
Atoms of a chemical element, that composes a molecule
Total Number of Atoms: 22
| Record |
Atom Name |
Symbol |
PDB Name |
Stereochemistry |
Is Aromatic |
Is Leaving Atom |
Charge |
X-Coordinate |
Y-Coordinate |
Z-Coordinate |
| 1 |
N |
N |
N |
N |
N |
N |
0 |
-1.377 |
-1.201 |
-2.417 |
| 2 |
CA |
C |
CA |
R |
N |
N |
0 |
-0.664 |
0.081 |
-2.349 |
| 3 |
CB |
C |
CB |
N |
N |
N |
0 |
0.084 |
0.179 |
-1.018 |
| 4 |
C |
C |
C |
N |
N |
N |
0 |
0.319 |
0.169 |
-3.487 |
| 5 |
O |
O |
O |
N |
N |
N |
0 |
0.824 |
-0.836 |
-3.928 |
| 6 |
OXT |
O |
OXT |
N |
N |
Y |
0 |
0.635 |
1.364 |
-4.01 |
| 7 |
SG |
S |
SG |
N |
N |
N |
0 |
-1.1 |
0.073 |
0.35 |
| 8 |
AS |
AS |
AS |
N |
N |
N |
0 |
0.299 |
0.246 |
2.09 |
| 9 |
CE1 |
C |
CE1 |
N |
N |
N |
0 |
-0.737 |
0.161 |
3.787 |
| 10 |
CE2 |
C |
CE2 |
N |
N |
N |
0 |
1.61 |
-1.249 |
2.038 |
| 11 |
H |
H |
1HN |
N |
N |
N |
0 |
-0.678 |
-1.925 |
-2.343 |
| 12 |
H2 |
H |
2HN |
N |
N |
Y |
0 |
-1.945 |
-1.261 |
-1.585 |
| 13 |
HA |
H |
HA |
N |
N |
N |
0 |
-1.38 |
0.899 |
-2.424 |
| 14 |
HB2 |
H |
1HB |
N |
N |
N |
0 |
0.613 |
1.131 |
-0.969 |
| 15 |
HB3 |
H |
2HB |
N |
N |
N |
0 |
0.8 |
-0.638 |
-0.943 |
| 16 |
HE21 |
H |
1HE2 |
N |
N |
N |
0 |
2.178 |
-1.202 |
1.109 |
| 17 |
HXT |
H |
HXT |
N |
N |
Y |
0 |
1.267 |
1.42 |
-4.74 |
| 18 |
HE11 |
H |
1HE1 |
N |
N |
N |
0 |
-0.056 |
0.245 |
4.633 |
| 19 |
HE12 |
H |
2HE1 |
N |
N |
N |
0 |
-1.455 |
0.98 |
3.815 |
| 20 |
HE13 |
H |
3HE1 |
N |
N |
N |
0 |
-1.268 |
-0.789 |
3.841 |
| 21 |
HE22 |
H |
2HE2 |
N |
N |
N |
0 |
2.291 |
-1.165 |
2.884 |
| 22 |
HE23 |
H |
3HE2 |
N |
N |
N |
0 |
1.079 |
-2.2 |
2.092 |
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