SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4iql'

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.
1C4D_A_DVAA6_0
(GRAMICIDIN A)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
3 / 3 ALA A  42
VAL A  20
TRP A  21
None
FMN  A 401 (-3.8A)
None
0.85A 1c4dA-4iqlA:
undetectable
1c4dB-4iqlA:
undetectable
1c4dA-4iqlA:
5.68
1c4dB-4iqlA:
5.68
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.
1EE2_A_CHDA1150_0
(ALCOHOL
DEHYDROGENASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 11 CYH A  57
LEU A  50
SER A  44
MET A  45
VAL A  67
None
None
NDP  A 402 (-2.8A)
NDP  A 402 ( 4.7A)
None
1.33A 1ee2A-4iqlA:
undetectable
1ee2A-4iqlA:
22.98
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.
1EE2_B_CHDB1250_1
(ALCOHOL
DEHYDROGENASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 11 CYH A  57
LEU A  50
SER A  44
MET A  45
VAL A  67
None
None
NDP  A 402 (-2.8A)
NDP  A 402 ( 4.7A)
None
1.33A 1ee2B-4iqlA:
undetectable
1ee2B-4iqlA:
22.98
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.
1HSH_A_MK1A401_1
(HIV-II PROTEASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 GLY A  43
ALA A  42
ILE A  83
VAL A  91
ILE A  79
FMN  A 401 (-4.8A)
None
None
None
None
0.84A 1hshA-4iqlA:
undetectable
1hshA-4iqlA:
15.72
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.
1L2I_B_CCSB417_0
(ESTROGEN RECEPTOR)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 6 PRO A  64
PHE A  65
LYS A 111
VAL A  91
None
1.19A 1l2iB-4iqlA:
undetectable
1l2iB-4iqlA:
21.18
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.
1YA3_B_STRB2001_1
(MINERALOCORTICOID
RECEPTOR)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 SER A 198
LEU A 197
ARG A 212
MET A  19
LEU A  27
None
None
None
FMN  A 401 (-4.0A)
None
1.47A 1ya3B-4iqlA:
undetectable
1ya3B-4iqlA:
21.64
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.
2C8A_B_NCAB1246_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 7 GLY A 192
SER A 198
PHE A 195
GLU A 289
FMN  A 401 (-3.4A)
None
None
None
1.09A 2c8aB-4iqlA:
undetectable
2c8aB-4iqlA:
19.09
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.
2RKG_B_AB1B501_2
(PROTEASE RETROPEPSIN)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 GLY A  43
ALA A  42
ILE A  83
VAL A  91
ILE A  79
FMN  A 401 (-4.8A)
None
None
None
None
0.79A 2rkgB-4iqlA:
undetectable
2rkgB-4iqlA:
16.61
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.
2YGO_A_PCFA1213_1
(WNT INHIBITORY
FACTOR 1)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 6 ILE A 313
MET A 309
PRO A 310
VAL A 166
None
1.17A 2ygoA-4iqlA:
undetectable
2ygoA-4iqlA:
20.96
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.
3AQI_A_CHDA2_0
(FERROCHELATASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 6 MET A  80
PRO A  47
GLY A  43
MET A  45
None
NDP  A 403 ( 4.9A)
FMN  A 401 (-4.8A)
NDP  A 402 ( 4.7A)
1.26A 3aqiA-4iqlA:
undetectable
3aqiA-4iqlA:
22.77
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.
3AQI_B_CHDB4_0
(FERROCHELATASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 6 MET A  80
PRO A  47
GLY A  43
MET A  45
None
NDP  A 403 ( 4.9A)
FMN  A 401 (-4.8A)
NDP  A 402 ( 4.7A)
1.28A 3aqiB-4iqlA:
undetectable
3aqiB-4iqlA:
22.77
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.
3MB5_A_SAMA301_0
(SAM-DEPENDENT
METHYLTRANSFERASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 VAL A 134
GLY A 170
ALA A 168
ILE A 278
ARG A 230
None
FMN  A 401 (-3.3A)
None
FMN  A 401 ( 4.9A)
None
1.05A 3mb5A-4iqlA:
undetectable
3mb5A-4iqlA:
23.41
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.
3P4W_D_DSFD319_1
(GLR4197 PROTEIN)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 10 PRO A  70
VAL A  91
TYR A  73
ILE A  79
ILE A  83
FMN  A 401 ( 4.5A)
None
NDP  A 403 (-4.4A)
None
None
1.23A 3p4wD-4iqlA:
undetectable
3p4wD-4iqlA:
21.64
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.
3S43_A_478A401_2
(PROTEASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 10 GLY A  43
ALA A  42
ILE A  83
VAL A  91
ILE A  79
FMN  A 401 (-4.8A)
None
None
None
None
0.81A 3s43B-4iqlA:
undetectable
3s43B-4iqlA:
14.11
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.
3WG7_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 6 ILE A  15
LEU A  39
ARG A 194
THR A 193
None
None
None
FMN  A 401 (-3.6A)
1.16A 3wg7A-4iqlA:
undetectable
3wg7J-4iqlA:
undetectable
3wg7A-4iqlA:
21.09
3wg7J-4iqlA:
10.21
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.
4HWK_A_SFYA807_0
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 11 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
None
1.26A 4hwkA-4iqlA:
0.9
4hwkA-4iqlA:
24.55
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.
4HWK_B_SFYB806_0
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 11 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
None
1.27A 4hwkB-4iqlA:
undetectable
4hwkB-4iqlA:
24.55
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.
4HWK_C_SFYC804_0
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
None
1.27A 4hwkC-4iqlA:
undetectable
4hwkC-4iqlA:
24.55
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.
4HWK_D_SFYD803_0
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 11 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
None
1.28A 4hwkD-4iqlA:
undetectable
4hwkD-4iqlA:
24.55
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.
4J7U_D_YTZD802_1
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 8 SER A 222
LEU A 223
PHE A 236
TYR A 237
None
1.04A 4j7uD-4iqlA:
undetectable
4j7uD-4iqlA:
24.55
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.
4J7X_A_SASA806_1
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
None
1.22A 4j7xA-4iqlA:
undetectable
4j7xA-4iqlA:
24.55
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.
4J7X_B_SASB804_1
(SEPIAPTERIN
REDUCTASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 SER A 222
LEU A 223
PHE A 236
TYR A 237
ALA A 242
None
1.25A 4j7xB-4iqlA:
undetectable
4j7xB-4iqlA:
24.55
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.
4MME_B_29QB603_1
(TRANSPORTER)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 9 VAL A  31
ALA A  30
GLY A 192
PHE A 195
SER A  23
None
None
FMN  A 401 (-3.4A)
None
None
1.00A 4mmeB-4iqlA:
undetectable
4mmeB-4iqlA:
21.83
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.
4R38_A_RBFA201_1
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 ALA A 196
ALA A 262
ILE A 266
ASN A 144
GLY A 279
FMN  A 401 ( 4.9A)
None
FMN  A 401 ( 4.7A)
NA  A 407 (-3.3A)
FMN  A 401 ( 3.9A)
0.96A 4r38A-4iqlA:
undetectable
4r38A-4iqlA:
17.17
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.
4R38_C_RBFC201_1
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 ALA A 196
ALA A 262
ILE A 266
ASN A 144
GLY A 279
FMN  A 401 ( 4.9A)
None
FMN  A 401 ( 4.7A)
NA  A 407 (-3.3A)
FMN  A 401 ( 3.9A)
1.00A 4r38C-4iqlA:
undetectable
4r38C-4iqlA:
17.17
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.
5ARF_A_SAMA1002_0
(N-LYSINE
METHYLTRANSFERASE
SMYD2)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 LYS A 263
GLY A 260
GLU A 275
ASN A 234
HIS A 204
NDP  A 403 (-2.7A)
NDP  A 403 (-3.8A)
None
None
GOL  A 404 (-4.9A)
1.30A 5arfA-4iqlA:
undetectable
5arfA-4iqlA:
21.56
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.
5E5J_A_017A201_1
(PROTEASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 GLY A  43
ALA A  42
ILE A  83
VAL A  91
ILE A  79
FMN  A 401 (-4.8A)
None
None
None
None
0.75A 5e5jA-4iqlA:
undetectable
5e5jA-4iqlA:
14.11
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.
5T8H_B_478B401_1
(PROTEASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 GLY A  43
ALA A  42
ILE A  83
VAL A  91
ILE A  79
FMN  A 401 (-4.8A)
None
None
None
None
0.76A 5t8hA-4iqlA:
undetectable
5t8hA-4iqlA:
14.11
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.
5T8H_B_478B401_2
(PROTEASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 GLY A  43
ALA A  42
ILE A  83
VAL A  91
ILE A  79
FMN  A 401 (-4.8A)
None
None
None
None
0.79A 5t8hB-4iqlA:
undetectable
5t8hB-4iqlA:
14.11
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.
6EMU_C_SAMC301_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 12 PRO A  13
ILE A  15
VAL A 189
VAL A 167
ASP A 187
None
0.96A 6emuC-4iqlA:
undetectable
6emuC-4iqlA:
24.04
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.
6EU9_D_READ601_1
(RETINOIC ACID
RECEPTOR)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
4 / 7 LEU A 221
GLY A 142
LEU A 276
GLY A 274
None
NA  A 407 (-4.0A)
None
None
0.75A 6eu9D-4iqlA:
undetectable
6eu9D-4iqlA:
12.80
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.
6NM4_B_SAMB402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 9 ILE A  40
ALA A  28
GLY A  38
LEU A  37
GLY A 192
None
None
None
None
FMN  A 401 (-3.4A)
1.25A 6nm4B-4iqlA:
undetectable
6nm4B-4iqlA:
20.48
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.
6R2E_G_FFOG403_0
(THYMIDYLATE SYNTHASE)
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis)
5 / 11 ILE A 266
TRP A  21
ASP A 270
GLY A 269
PHE A 207
FMN  A 401 ( 4.7A)
None
None
None
None
1.31A 6r2eG-4iqlA:
undetectable
6r2eG-4iqlA:
23.42