SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4g68'

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.
1EKJ_F_ACTF3008_0
(BETA-CARBONIC
ANHYDRASE)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 8 PHE B 271
TYR B 144
GLY B 264
GLY B 263
 None
 0.78A 1ekjE-4g68B:
undetectable
1ekjF-4g68B:
undetectable		 1ekjE-4g68B:
21.03
1ekjF-4g68B:
21.03
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.
1FM9_A_9CRA201_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.90A 1fm9A-4g68B:
undetectable		 1fm9A-4g68B:
21.32
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.
1J96_A_TESA903_1
(3ALPHA-HYDROXYSTEROI
D DEHYDROGENASE TYPE
3)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 6 TYR B 301
TRP B 191
ILE B 380
LEU B 343
 None
XYP  B 802 (-4.2A)
None
None
 1.21A 1j96A-4g68B:
undetectable		 1j96A-4g68B:
22.55
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.
1K74_A_9CRA463_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.90A 1k74A-4g68B:
undetectable		 1k74A-4g68B:
21.32
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.
1RI4_A_SAMA299_0
(MRNA CAPPING ENZYME)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 GLY B 304
ILE B 302
ALA B 377
SER B 374
TYR B 301
 None
None
XYP  B 802 (-3.4A)
None
None
 1.01A 1ri4A-4g68B:
undetectable		 1ri4A-4g68B:
21.14
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.
1XLS_A_9CRA801_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.91A 1xlsA-4g68B:
undetectable		 1xlsA-4g68B:
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.
1XLS_B_9CRB802_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.90A 1xlsB-4g68B:
undetectable		 1xlsB-4g68B:
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.
1XLS_C_9CRC803_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.91A 1xlsC-4g68B:
undetectable		 1xlsC-4g68B:
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.
1XLS_D_9CRD804_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.90A 1xlsD-4g68B:
undetectable		 1xlsD-4g68B:
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.
2DM6_A_IMNA1401_1
(NADP-DEPENDENT
LEUKOTRIENE B4
12-HYDROXYDEHYDROGEN
ASE)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 10 TYR B 261
ALA B 180
ILE B 283
PRO B 158
ILE B 145
 None
 1.27A 2dm6A-4g68B:
undetectable
2dm6B-4g68B:
undetectable		 2dm6A-4g68B:
22.42
2dm6B-4g68B:
22.42
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.
2VCV_A_ASDA1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 7 TYR B 144
PHE B 271
ALA B 249
ALA B 270
 None
 0.95A 2vcvA-4g68B:
undetectable		 2vcvA-4g68B:
18.89
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.
2XZ5_B_ACHB1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 8 TYR B 407
SER B 215
GLN B 410
ILE B 415
 None
 1.17A 2xz5B-4g68B:
undetectable
2xz5E-4g68B:
undetectable		 2xz5B-4g68B:
18.16
2xz5E-4g68B:
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.
3FPJ_A_SAMA301_0
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ILE B 302
GLY B 303
VAL B 375
ILE B 380
ALA B 140
 None
 0.93A 3fpjA-4g68B:
undetectable		 3fpjA-4g68B:
20.78
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.
3H0A_A_9RAA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.83A 3h0aA-4g68B:
undetectable		 3h0aA-4g68B:
20.54
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.
4XO7_B_ASDB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 7 TYR B 301
TRP B 191
ILE B 380
LEU B 343
 None
XYP  B 802 (-4.2A)
None
None
 1.16A 4xo7B-4g68B:
undetectable		 4xo7B-4g68B:
22.10
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.
4YV5_B_SVRB207_2
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 7 LYS B 280
LYS B 282
TYR B 144
PHE B 179
 None
 1.23A 4yv5B-4g68B:
1.4		 4yv5B-4g68B:
13.90
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_A_CVIA301_1
(REGULATORY PROTEIN
TETR)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 8 GLY B 342
TRP B 191
ARG B 246
ASP B 267
 None
XYP  B 802 (-4.2A)
XYP  B 801 ( 3.0A)
None
 0.94A 5vlmA-4g68B:
undetectable		 5vlmA-4g68B:
17.49
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_B_CVIB301_1
(REGULATORY PROTEIN
TETR)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 8 GLY B 342
TRP B 191
ARG B 246
ASP B 267
 None
XYP  B 802 (-4.2A)
XYP  B 801 ( 3.0A)
None
 0.96A 5vlmB-4g68B:
undetectable		 5vlmB-4g68B:
17.49
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.
5Z12_B_9CRB501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 12 ALA B 324
ALA B 325
LEU B 309
LEU B  27
LEU B 105
 None
 0.91A 5z12B-4g68B:
undetectable		 5z12B-4g68B:
10.50
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.
6DRY_A_H8DA2001_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		5 / 11 THR B 177
LEU B 164
ALA B 258
PHE B 150
VAL B 155
 None
 1.24A 6dryA-4g68B:
undetectable		 6dryA-4g68B:
21.70
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.
6EXI_D_ADND502_1
(ADENOSYLHOMOCYSTEINA
SE)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		3 / 3 LEU B 393
ASN B 416
LEU B 382
 None
 0.71A 6exiD-4g68B:
undetectable		 6exiD-4g68B:
12.53
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.
6G31_G_ZOLG401_0
(GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE)		 4g68 ABC TRANSPORTER
(Caldanaerobius) 		4 / 7 ASP B 185
ASP B  66
LYS B 391
GLN B 388
 None
 1.18A 6g31G-4g68B:
undetectable		 6g31G-4g68B:
11.06