SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3i6t'

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.
1HBP_A_RTLA184_0
(RETINOL BINDING
PROTEIN)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 11 LEU A 112
ALA A  66
ALA A  70
VAL A  79
LEU A  40
 None
 1.02A 1hbpA-3i6tA:
undetectable		 1hbpA-3i6tA:
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.
1OLT_A_SAMA501_0
(OXYGEN-INDEPENDENT
COPROPORPHYRINOGEN
III OXIDASE)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 ASP A 247
GLY A 296
ASP A 297
ILE A 270
ALA A 107
 MG  A 381 (-3.1A)
None
None
None
None
 1.36A 1oltA-3i6tA:
3.7		 1oltA-3i6tA:
24.43
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.
1Q23_H_FUAH709_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 PHE A 299
SER A  55
LEU A 331
VAL A  35
HIS A 305
 None
 1.23A 1q23H-3i6tA:
undetectable
1q23I-3i6tA:
undetectable		 1q23H-3i6tA:
19.37
1q23I-3i6tA:
19.37
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.
2KCE_B_D16B568_1
(THYMIDYLATE SYNTHASE)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		6 / 12 HIS A 310
LEU A  16
ASP A 334
LEU A 336
GLY A 302
VAL A 359
 None
 1.46A 2kceB-3i6tA:
undetectable		 2kceB-3i6tA:
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.
3CB8_A_SAMA501_0
(PYRUVATE
FORMATE-LYASE
1-ACTIVATING ENZYME)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 TYR A 325
HIS A 305
SER A  55
LEU A 331
TYR A 329
 None
 1.34A 3cb8A-3i6tA:
3.8		 3cb8A-3i6tA:
19.16
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.
3D90_B_NOGB2001_1
(PROGESTERONE
RECEPTOR)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 LEU A  16
LEU A  18
LEU A 303
LEU A  13
TYR A  68
 None
 1.28A 3d90B-3i6tA:
undetectable		 3d90B-3i6tA:
18.16
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.
3R24_A_SAMA302_1
(2'-O-METHYL
TRANSFERASE)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		3 / 3 TYR A 329
ASP A 344
ASP A 160
 None
 0.73A 3r24A-3i6tA:
undetectable		 3r24A-3i6tA:
21.50
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.
4AC9_C_DXCC1476_0
(MJ0495-LIKE PROTEIN)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 5 ILE A 270
ALA A 279
HIS A 310
MET A 311
 None
 1.26A 4ac9B-3i6tA:
4.7
4ac9C-3i6tA:
2.3		 4ac9B-3i6tA:
19.60
4ac9C-3i6tA:
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.
4ACA_C_DXCC1476_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 5 ILE A 270
ALA A 279
HIS A 310
MET A 311
 None
 1.23A 4acaB-3i6tA:
4.9
4acaC-3i6tA:
2.1		 4acaB-3i6tA:
19.60
4acaC-3i6tA:
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.
4EAT_B_BEZB1000_0
(BENZOATE-COENZYME A
LIGASE)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 9 ALA A   9
GLY A  10
ILE A   8
GLY A  81
ILE A   7
 None
 1.09A 4eatB-3i6tA:
undetectable		 4eatB-3i6tA:
23.01
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.
4EQ4_B_SALB601_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 8 LEU A  40
ILE A   8
VAL A  84
GLY A  50
 None
 0.90A 4eq4B-3i6tA:
2.1		 4eq4B-3i6tA:
19.67
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.
4M5M_A_DX4A401_0
(2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 8 GLY A  50
THR A 110
LEU A 306
ARG A 118
 None
 1.03A 4m5mA-3i6tA:
undetectable		 4m5mA-3i6tA:
19.06
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.
4NC3_A_ERMA1202_2
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 6 THR A 110
LEU A  13
LEU A  16
GLU A  36
 None
 1.08A 4nc3A-3i6tA:
undetectable		 4nc3A-3i6tA:
24.12
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.
4P6V_E_RBFE201_1
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT B
NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT E)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 5 HIS A  15
VAL A  37
GLU A  36
VAL A 369
 None
 1.16A 4p6vB-3i6tA:
undetectable
4p6vE-3i6tA:
undetectable		 4p6vB-3i6tA:
23.24
4p6vE-3i6tA:
20.62
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.
4ZXI_A_GLYA1402_0
(TYROCIDINE
SYNTHETASE 3)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 7 ASP A 192
ILE A 164
GLY A 321
THR A 219
 None
 1.08A 4zxiA-3i6tA:
undetectable		 4zxiA-3i6tA:
14.09
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.
5H5F_A_SAMA301_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
SFM1)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 LEU A 108
ILE A 270
ASP A 297
LEU A  40
ALA A 111
 None
 1.17A 5h5fA-3i6tA:
undetectable		 5h5fA-3i6tA:
20.46
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.
5IKT_B_TLFB601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 LEU A 276
LEU A 303
GLY A  52
ALA A 111
LEU A 108
 None
 1.25A 5iktB-3i6tA:
undetectable		 5iktB-3i6tA:
21.02
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.
5LJE_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 6 LEU A 115
ILE A 270
THR A 110
MET A 271
 None
 1.29A 5ljeA-3i6tA:
undetectable		 5ljeA-3i6tA:
15.22
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.
5NKN_A_LOCA201_1
(NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 GLY A 170
PHE A 171
MET A 154
ASP A 177
PHE A 176
 None
 1.15A 5nknA-3i6tA:
undetectable		 5nknA-3i6tA:
12.07
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.
5UXD_B_ZITB501_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E MPHH)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 ILE A 221
LEU A 245
ASP A 247
LEU A 181
GLY A 321
 None
None
MG  A 381 (-3.1A)
None
None
 1.14A 5uxdB-3i6tA:
undetectable		 5uxdB-3i6tA:
24.17
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.
5XV7_A_EMHA705_2
(SERINE-ARGININE (SR)
PROTEIN KINASE 1)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 4 VAL A  38
LEU A  16
LEU A  18
ASP A 334
 None
 1.22A 5xv7A-3i6tA:
undetectable		 5xv7A-3i6tA:
12.33
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.
6B0I_B_TA1B502_1
(TUBULIN BETA CHAIN)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 VAL A 359
ASP A 358
LEU A  40
ARG A 116
GLY A 354
 None
 0.99A 6b0iB-3i6tA:
undetectable		 6b0iB-3i6tA:
11.70
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.
6B0L_B_TA1B502_1
(TUBULIN BETA CHAIN)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		5 / 12 VAL A 359
ASP A 358
LEU A  40
ARG A 116
GLY A 354
 None
 0.90A 6b0lB-3i6tA:
undetectable		 6b0lB-3i6tA:
11.70
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.
6CI6_A_NBOA607_1
(SERUM ALBUMIN)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 7 ALA A  70
GLU A 103
LYS A 105
LEU A 108
 None
 1.07A 6ci6A-3i6tA:
undetectable		 6ci6A-3i6tA:
13.88
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.
6MN5_A_LLLA301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 6 ASP A 247
TYR A 294
GLU A 323
ASP A 297
 MG  A 381 (-3.1A)
None
None
None
 1.24A 6mn5A-3i6tA:
undetectable		 6mn5A-3i6tA:
11.83
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.
6MN5_A_LLLA301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 6 ASP A 297
TYR A 294
GLU A 222
ASP A 196
 None
None
MG  A 381 (-3.0A)
MG  A 381 (-2.8A)
 1.48A 6mn5A-3i6tA:
undetectable		 6mn5A-3i6tA:
11.83
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.
6MN5_B_LLLB301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 7 ASP A 247
TYR A 294
GLU A 323
ASP A 297
 MG  A 381 (-3.1A)
None
None
None
 1.21A 6mn5B-3i6tA:
undetectable		 6mn5B-3i6tA:
11.83
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.
6MN5_C_LLLC301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3i6t MUCONATE
CYCLOISOMERASE
(Jannaschia
sp.
CCS1) 		4 / 6 ASP A 247
TYR A 294
GLU A 323
ASP A 297
 MG  A 381 (-3.1A)
None
None
None
 1.21A 6mn5C-3i6tA:
undetectable		 6mn5C-3i6tA:
11.83