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PDBsum entry 2tsr
Go to PDB code:
Ligand/metal interactions
PDB id
2tsr
4 instances of ligand highlighted
D16
Ligands
UMP
×4
UMP 308(A)
D16
×4
D16 309(A)
Ligand
D16
-
Tomudex
[Zd1694; raltitrexed]
Formula:
C
21
H
22
N
4
O
6
S
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
D16 309(A)
32
32
0
0
Complete
Chiral checks - OK
Advanced Analysis
Residue
Name Mismatches
Count
D16 309(A)
O2: O1
|
O1: O2
2
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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3D Viewers:
Ligand matches this enzyme's product 7,8-dihydrofolate with similarity 45.45%
LIGPLOT
of interactions involving ligand D16
List of
interactions
D16 309(A)
also representing 3 other equivalent ligands:
D16 409(B)
D16 509(C)
D16 609(D)
