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PDBsum entry 4ki1
Go to PDB code:
Ligand/metal interactions
PDB id
4ki1
4 instances of ligand highlighted
NAG-NAG-BMA-MAN-
MAN
Ligands
NAG-NAG-BMA-MAN-
MAN
×4
NAG 1(I) to MAN 5(I)
Ligand
NAG-NAG-BMA-MAN-MAN
NAG
-
2-Acetamido-2-Deoxy-Beta-D-Glucopyranose [N-Acetyl-Beta-D-Glucosamine; 2-Acetamido-2-Deoxy-Beta- D-Glucose; 2-Acetamido-2-Deoxy-D-Glucose; 2-Acetamido- 2-Deoxy-Glucose; n-Acetyl-D-Glucosamine]
Formula:
C
8
H
15
NO
6
BMA
-
Beta-D-Mannopyranose [Beta-D-Mannose; d-Mannose; mannose]
Formula:
C
6
H
12
O
6
MAN
-
Alpha-D-Mannopyranose [Alpha-D-Mannose; d-Mannose; mannose]
Formula:
C
6
H
12
O
6
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
NAG 1(I)
15
15
1
1
Complete
Chiral checks - OK
NAG 2(I)
15
15
1
0
Complete
Chiral checks - OK
BMA 3(I)
12
12
1
0
Complete
Chiral checks - OK
MAN 4(I)
12
12
1
0
Complete
Chiral checks - OK
MAN 5(I)
12
12
1
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 NAG-NAG-BMA-MAN-MAN
List of
interactions
NAG 1(I) to MAN 5(I)
also representing 3 other equivalent ligands:
NAG 1(J) to MAN 5(J)
NAG 1(K) to MAN 5(K)
NAG 1(L) to MAN 5(L)
