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PDBsum entry 1mcd
Go to PDB code:
Ligand/metal interactions
PDB id
1mcd
Ligand highlighted
ACE-DPN-BAL-HIS-
DPR-NH2
Ligands
ACE-DPN-BAL-HIS-
DPR-NH2
ACE 0(P) to NH2 5(P)
Ligand
ACE-DPN-BAL-HIS-DPR-NH2
ACE
-
Acetyl group
Formula:
C
2
H
4
O
DPN
-
D-Phenylalanine
Formula:
C
9
H
11
NO
2
BAL
-
Beta-Alanine
Formula:
C
3
H
7
NO
2
DPR
-
D-Proline
Formula:
C
5
H
9
NO
2
NH2
-
Amino group
Formula:
H
2
N
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
ACE 0(P)
3
-
-
-
Residue too small to validate
DPN 1(P)
12
12
1
1
Complete
Chiral checks - OK
BAL 2(P)
6
-
-
-
Residue too small to validate
HIS 3(P)
11
11
1
1
Complete
Chiral checks - OK
DPR 4(P)
8
8
1
1
Complete
Chiral checks - OK
NH2 5(P)
1
-
-
-
Residue too small to validate
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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of interactions involving ligand ACE-DPN-BAL-HIS-DPR-NH2
List of
interactions
ACE 0(P) to NH2 5(P)
