SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3i1a'

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.
1AV2_B_DVAB8_0
(GRAMICIDIN A)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		3 / 3 VAL A 253
VAL A 250
TRP A 254
 None
 0.94A 1av2A-3i1aA:
undetectable
1av2B-3i1aA:
undetectable		 1av2A-3i1aA:
3.46
1av2B-3i1aA:
3.46
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.
1KYV_B_RBFB502_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		5 / 11 ILE A 246
LEU A 243
HIS A 210
GLY A 122
HIS A 129
 None
 1.41A 1kyvA-3i1aA:
undetectable
1kyvB-3i1aA:
undetectable		 1kyvA-3i1aA:
16.82
1kyvB-3i1aA:
16.82
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.
2A3A_A_TEPA1436_1
(CHITINASE)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		3 / 3 ASP A 212
PHE A 245
ARG A 284
 None
 0.90A 2a3aA-3i1aA:
undetectable		 2a3aA-3i1aA:
21.92
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.
2VUF_A_FUAA2002_1
(SERUM ALBUMIN)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 9 ARG A 187
PHE A 317
VAL A 323
GLU A 324
 DMS  A 341 (-4.4A)
None
None
None
 0.86A 2vufA-3i1aA:
2.3		 2vufA-3i1aA:
19.73
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.
3A3Y_A_OBNA6000_1
(NA, K-ATPASE ALPHA
SUBUNIT)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		5 / 10 GLU A 240
GLY A 248
VAL A 253
PHE A 263
LEU A 121
 None
 1.04A 3a3yA-3i1aA:
undetectable		 3a3yA-3i1aA:
17.60
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.
4AT0_A_ACTA1490_0
(3-KETOSTEROID-DELTA4
-5ALPHA-DEHYDROGENAS
E)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		3 / 3 GLU A 283
TYR A 279
SER A 196
 None
 0.81A 4at0A-3i1aA:
undetectable		 4at0A-3i1aA:
20.50
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.
4EJJ_A_NCTA501_1
(CYTOCHROME P450 2A6)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 7 PHE A 177
PHE A 317
ILE A 289
PHE A 313
 None
 0.91A 4ejjA-3i1aA:
undetectable		 4ejjA-3i1aA:
22.04
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.
4HFP_B_15UB402_1
(PROTHROMBIN)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		5 / 12 LEU A 113
ILE A 246
GLU A  76
GLY A 122
GLY A 266
 None
 1.15A 4hfpB-3i1aA:
undetectable		 4hfpB-3i1aA:
19.60
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.
4IKJ_A_SUZA201_1
(TRANSTHYRETIN)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 7 LYS A 311
LEU A 307
LEU A 170
SER A 176
 None
 0.97A 4ikjA-3i1aA:
undetectable
4ikjB-3i1aA:
undetectable		 4ikjA-3i1aA:
16.50
4ikjB-3i1aA:
16.50
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.
4IKK_B_SUZB201_1
(TRANSTHYRETIN)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 7 SER A 176
LYS A 311
LEU A 307
LEU A 170
 None
 0.92A 4ikkA-3i1aA:
undetectable
4ikkB-3i1aA:
undetectable		 4ikkA-3i1aA:
16.50
4ikkB-3i1aA:
16.50
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.
4IKL_B_SUZB201_1
(TRANSTHYRETIN)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 8 SER A 176
LYS A 311
LEU A 307
LEU A 170
 None
 0.93A 4iklA-3i1aA:
undetectable
4iklB-3i1aA:
undetectable		 4iklA-3i1aA:
16.50
4iklB-3i1aA:
16.50
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.
4Z69_A_DIFA1007_1
(SERUM ALBUMIN)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		5 / 9 ARG A 306
LEU A 297
ILE A 161
SER A 176
ALA A 172
 None
 1.50A 4z69A-3i1aA:
2.6		 4z69A-3i1aA:
19.73
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.
5DNU_A_BEZA319_0
(SHKAI2IB)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 5 GLN A  90
ILE A  97
ILE A  98
TYR A  19
 None
 1.28A 5dnuA-3i1aA:
undetectable		 5dnuA-3i1aA:
19.26
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.
5VLM_H_CVIH301_1
(REGULATORY PROTEIN
TETR)		 3i1a SPECTINOMYCIN
PHOSPHOTRANSFERASE
(Legionella
pneumophila) 		4 / 8 GLN A 120
GLY A 122
ILE A 128
ASP A 242
 None
 1.01A 5vlmH-3i1aA:
2.2		 5vlmH-3i1aA:
19.81