SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3a18'

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.
1ZQ9_B_SAMB4001_0
(PROBABLE
DIMETHYLADENOSINE
TRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 320
GLY A 154
GLY A 156
VAL A  96
ILE A 280
 BXO  A 355 (-3.8A)
None
None
None
None
 0.99A 1zq9B-3a18A:
undetectable		 1zq9B-3a18A:
19.84
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.
2E7F_A_C2FA3000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 GLY A 281
SER A 260
ASN A 261
ARG A 345
ILE A 280
 None
 1.28A 2e7fA-3a18A:
undetectable		 2e7fA-3a18A:
22.81
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.
2E7F_B_C2FB4000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 GLY A 281
SER A 260
ASN A 261
ARG A 345
ILE A 280
 None
 1.26A 2e7fB-3a18A:
undetectable		 2e7fB-3a18A:
22.81
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.
2HA2_B_SCKB951_1
(ACETYLCHOLINESTERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 8 TYR A  98
ASP A  80
TYR A 278
HIS A  84
 None
 1.35A 2ha2B-3a18A:
undetectable		 2ha2B-3a18A:
21.44
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.
2QJU_A_DSMA801_1
(TRANSPORTER)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 11 LEU A 318
LEU A 316
ARG A 317
PHE A 148
ALA A 224
 BXO  A 355 ( 4.9A)
None
None
None
None
 1.07A 2qjuA-3a18A:
undetectable		 2qjuA-3a18A:
20.58
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.
2VCT_A_ASDA1223_1
(GLUTATHIONE
S-TRANSFERASE A2)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 8 TYR A 146
ILE A 162
GLY A  32
LEU A  38
 None
 0.86A 2vctA-3a18A:
undetectable		 2vctA-3a18A:
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.
2VCT_C_ASDC1223_1
(GLUTATHIONE
S-TRANSFERASE A2)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 8 TYR A 146
ILE A 162
GLY A  32
LEU A  38
 None
 0.85A 2vctC-3a18A:
undetectable		 2vctC-3a18A:
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.
2VE3_A_REAA1445_1
(PUTATIVE CYTOCHROME
P450 120)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 PHE A  70
TRP A 117
ALA A  58
VAL A  48
GLY A  47
 None
 1.09A 2ve3A-3a18A:
undetectable		 2ve3A-3a18A:
22.15
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.
3K13_B_THHB643_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 GLY A 281
SER A 260
ASN A 261
ARG A 345
ILE A 280
 None
 1.28A 3k13B-3a18A:
undetectable		 3k13B-3a18A:
22.72
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.
3K13_C_THHC643_0
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 GLY A 281
SER A 260
ASN A 261
ARG A 345
ILE A 280
 None
 1.27A 3k13C-3a18A:
undetectable		 3k13C-3a18A:
22.72
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.
3T8N_D_EDTD135_0
(STEROID
DELTA-ISOMERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 11 GLY A 253
PRO A 254
ARG A 345
GLY A 281
ASP A 346
 None
 1.30A 3t8nD-3a18A:
undetectable
3t8nF-3a18A:
undetectable		 3t8nD-3a18A:
17.22
3t8nF-3a18A:
17.22
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.
3W9T_B_W9TB504_1
(HEMOLYTIC LECTIN
CEL-III)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 5 ASP A  86
GLY A 340
TYR A  90
GLN A  49
 None
 1.13A 3w9tB-3a18A:
undetectable		 3w9tB-3a18A:
20.66
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.
3W9T_C_W9TC1004_1
(HEMOLYTIC LECTIN
CEL-III)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 4 ASP A  86
GLY A 340
TYR A  90
GLN A  49
 None
 1.07A 3w9tC-3a18A:
0.0		 3w9tC-3a18A:
20.66
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.
3W9T_D_W9TD506_1
(HEMOLYTIC LECTIN
CEL-III)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 5 ASP A  86
GLY A 340
TYR A  90
GLN A  49
 None
 1.05A 3w9tD-3a18A:
undetectable		 3w9tD-3a18A:
20.66
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.
3W9T_E_W9TE505_1
(HEMOLYTIC LECTIN
CEL-III)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 5 ASP A  86
GLY A 340
TYR A  90
GLN A  49
 None
 1.07A 3w9tE-3a18A:
undetectable		 3w9tE-3a18A:
20.66
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.
3W9T_G_W9TG505_1
(HEMOLYTIC LECTIN
CEL-III)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 5 ASP A  86
GLY A 340
TYR A  90
GLN A  49
 None
 1.13A 3w9tG-3a18A:
undetectable		 3w9tG-3a18A:
20.66
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.
4DJF_A_C2FA300_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 GLY A 281
SER A 260
ASN A 261
ARG A 345
ILE A 280
 None
 1.27A 4djfA-3a18A:
undetectable		 4djfA-3a18A:
22.81
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.
4EJW_A_SRYA2001_2
(TRANSCRIPTIONAL
REGULATOR TCAR)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 6 ILE A  94
ASN A  92
HIS A 282
VAL A 208
 None
 1.03A 4ejwB-3a18A:
undetectable		 4ejwB-3a18A:
16.76
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.
4QD3_A_5AEA201_1
(PEPTIDYL-TRNA
HYDROLASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 9 LEU A 193
GLY A 342
HIS A 282
VAL A 208
LEU A 331
 None
 1.13A 4qd3A-3a18A:
undetectable		 4qd3A-3a18A:
20.92
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.
4WZM_A_ACTA503_0
(RNA DEPENDENT RNA
POLYMERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 4 ASP A 225
ASP A 222
ASP A 151
ALA A 224
 None
 0.94A 4wzmA-3a18A:
0.3		 4wzmA-3a18A:
23.67
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.
4ZDZ_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 7 PHE A 307
PHE A  27
GLY A 170
LEU A 145
 None
HEM  A 354 (-4.4A)
HEM  A 354 (-3.5A)
BXO  A 355 ( 4.7A)
 0.95A 4zdzA-3a18A:
undetectable		 4zdzA-3a18A:
21.11
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.
5DZK_2_BEZ2801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
BEZ-LEU-LEU)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 4 LEU A  46
ARG A 262
ILE A  94
ILE A 280
 None
 1.23A 5dzk2-3a18A:
undetectable
5dzkM-3a18A:
undetectable
5dzkN-3a18A:
undetectable		 5dzk2-3a18A:
6.90
5dzkM-3a18A:
18.09
5dzkN-3a18A:
18.09
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.
5ESF_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 8 PHE A 307
PHE A  27
GLY A 170
LEU A 145
 None
HEM  A 354 (-4.4A)
HEM  A 354 (-3.5A)
BXO  A 355 ( 4.7A)
 0.94A 5esfA-3a18A:
undetectable		 5esfA-3a18A:
20.75
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 7 SER A 174
GLY A 173
ARG A 178
LEU A 145
 HEM  A 354 (-2.9A)
HEM  A 354 (-3.7A)
HEM  A 354 ( 4.2A)
BXO  A 355 ( 4.7A)
 1.04A 6btxA-3a18A:
undetectable		 6btxA-3a18A:
21.35
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.
6EBP_A_DAHA123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 9 LEU A 145
THR A 144
SER A 163
ILE A 162
ILE A 166
 BXO  A 355 ( 4.7A)
None
None
None
None
 1.28A 6ebpA-3a18A:
undetectable		 6ebpA-3a18A:
15.56
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.
6EF6_A_ACTA405_0
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 6 ARG A 132
PRO A  76
GLN A 105
ILE A 114
 None
 1.08A 6ef6A-3a18A:
0.3		 6ef6A-3a18A:
26.29
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.
6J20_A_GBQA1201_1
(SUBSTANCE-P
RECEPTOR,ENDOLYSIN)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 7 ILE A  66
TRP A  99
HIS A  79
VAL A  95
 None
 1.00A 6j20A-3a18A:
undetectable		 6j20A-3a18A:
19.79
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.
6N7F_A_RBFA502_0
(PUTATIVE GLUTATHIONE
REDUCTASE (GR))		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 7 GLY A   6
HIS A 169
GLU A 165
GLY A 164
 None
HEM  A 354 (-4.0A)
None
None
 0.87A 6n7fA-3a18A:
undetectable		 6n7fA-3a18A:
10.74