SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3iir'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WRK_A_TFPA204_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 3iir TRYPSIN INHIBITOR
(Murraya
koenigii) 		5 / 9 PHE A  60
PHE A  79
VAL A  45
LEU A 164
LEU A  31
 None
 1.23A 1wrkA-3iirA:
undetectable
1wrkB-3iirA:
undetectable		 1wrkA-3iirA:
16.40
1wrkB-3iirA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A15_A_NCAA1001_0
(HYPOTHETICAL PROTEIN
RV0760C)		 3iir TRYPSIN INHIBITOR
(Murraya
koenigii) 		5 / 11 VAL A 154
ILE A 105
LEU A 164
LEU A  19
LEU A  31
 None
 1.10A 2a15A-3iirA:
undetectable		 2a15A-3iirA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BWC_B_SAMB501_0
(SPERMIDINE SYNTHASE)		 3iir TRYPSIN INHIBITOR
(Murraya
koenigii) 		5 / 12 GLY A 133
ILE A   6
VAL A  22
GLY A   8
ASP A 131
 None
 0.94A 3bwcB-3iirA:
undetectable		 3bwcB-3iirA:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P2K_A_SAMA6735_1
(16S RRNA METHYLASE)		 3iir TRYPSIN INHIBITOR
(Murraya
koenigii) 		3 / 3 ASP A  94
GLU A  87
SER A  99
 None
 0.80A 3p2kA-3iirA:
undetectable		 3p2kA-3iirA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TJ7_A_ACTA609_0
(GBAA_1210 PROTEIN)		 3iir TRYPSIN INHIBITOR
(Murraya
koenigii) 		3 / 3 LYS A 124
VAL A 138
HIS A 139
 None
 1.09A 3tj7A-3iirA:
undetectable		 3tj7A-3iirA:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TXN_B_URFB302_1
(URIDINE
PHOSPHORYLASE)		 3iir TRYPSIN INHIBITOR
(Murraya
koenigii) 		4 / 7 GLY A  28
GLN A  47
ARG A 162
ALA A  26
 None
 0.95A 4txnB-3iirA:
undetectable		 4txnB-3iirA:
21.78