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PDBsum entry 3atw
Go to PDB code:
Ligand/metal interactions
PDB id
3atw
2 instances of ligand highlighted
ACE-THR-VAL-ALC-
HSV
Ligands
ACE-THR-VAL-ALC-
HSV
×2
ACE 1(C) to HSV 5(C)
Ligand
ACE-THR-VAL-ALC-HSV
ACE
-
Acetyl group
Formula:
C
2
H
4
O
ALC
-
2-Amino-3-Cyclohexyl-Propionic acid
Formula:
C
9
H
17
NO
2
HSV
-
L-Histidinal
Formula:
C
6
H
10
N
3
O
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
ACE 1(C)
3
-
-
-
Residue too small to validate
THR 2(C)
8
8
1
1
Complete
Chiral checks - OK
VAL 3(C)
8
8
1
1
Complete
Chiral checks - OK
ALC 4(C)
12
12
1
1
Complete
Chiral checks - OK
HSV 5(C)
10
10
0
0
Complete
Chiral checks - OK
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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3D Viewers:
LIGPLOT
of interactions involving ligand ACE-THR-VAL-ALC-HSV
List of
interactions
ACE 1(C) to HSV 5(C)
(also representing equivalent ligand ACE 1(D) to HSV 5(D) )
