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PDBsum entry 1a2c
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Ligand/metal interactions
PDB id
1a2c
Ligand highlighted
34H-LEU-PRJ-OAR
Ligands
ASP-PHE-GLU-GLU-
ILE-PRO-GLU-GLU-
TYS-LEU
ASP 355(I) to LEU 364(I)
34H-LEU-PRJ-OAR
34H 1(J) to OAR 4(J)
Metals
_NA
NA 626(H)
Ligand
34H-LEU-PRJ-OAR
34H
-
(2r)-2-Hydroxy-3-(4-Hydroxyphenyl)propanoic acid
Formula:
C
9
H
10
O
4
PRJ
-
(2s,3as,6r,7as)-6-Hydroxyoctahydro-1h-Indole-2- Carboxylic acid
Formula:
C
9
H
15
NO
3
OAR
-
N-(4-Amino-5-Hydroxy-Pentyl)-Guanidine
Formula:
C
6
H
16
N
4
O
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
34H 1(J)
13
13
1
1
Complete
Chiral checks - OK
LEU 2(J)
9
9
1
1
Complete
Chiral checks - OK
PRJ 3(J)
13
13
1
1
Complete
Chiral checks - OK
OAR 4(J)
11
11
0
0
Complete
Chiral checks - OK
Advanced Analysis
Residue
Name Mismatches
Count
34H 1(J)
-
0
LEU 2(J)
O: OXT
1
PRJ 3(J)
-
0
OAR 4(J)
NH2: NH1
|
NH1: NH2
2
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 34H-LEU-PRJ-OAR
List of
interactions
34H 1(J) to OAR 4(J)
_NA
