SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4mnd'

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.
1HXB_A_ROCA100_2
(HIV-1 PROTEASE)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		3 / 3 ARG A 446
THR A 417
VAL A 414
 None
 0.89A 1hxbA-4mndA:
undetectable		 1hxbA-4mndA:
14.29
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.
2DTJ_B_THRB402_0
(ASPARTOKINASE)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 9 ILE A 189
ILE A 166
GLY A 185
ALA A 182
THR A 168
 None
 1.30A 2dtjA-4mndA:
undetectable
2dtjB-4mndA:
undetectable		 2dtjA-4mndA:
16.81
2dtjB-4mndA:
16.81
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.
2IGT_A_SAMA1001_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		3 / 3 ASP A 278
ASP A 171
ASP A 198
 None
 0.49A 2igtA-4mndA:
undetectable		 2igtA-4mndA:
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.
2IGT_B_SAMB1002_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		3 / 3 ASP A 278
ASP A 171
ASP A 198
 None
 0.46A 2igtB-4mndA:
2.0		 2igtB-4mndA:
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.
2ITZ_A_IREA2021_2
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		3 / 3 LEU A 108
LEU A  72
MET A  73
 None
 0.84A 2itzA-4mndA:
undetectable		 2itzA-4mndA:
22.80
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.
2Q64_B_1UNB1001_2
(PROTEASE RETROPEPSIN)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		3 / 3 ARG A 446
THR A 417
VAL A 414
 None
 0.94A 2q64A-4mndA:
undetectable		 2q64A-4mndA:
13.52
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.
2QAK_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		3 / 3 ARG A 446
THR A 417
VAL A 414
 None
 0.83A 2qakA-4mndA:
undetectable		 2qakA-4mndA:
12.18
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.
2VDY_A_HCYA1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 12 THR A 227
ARG A 184
ILE A 179
SER A 175
PHE A 229
 None
 1.34A 2vdyA-4mndA:
undetectable		 2vdyA-4mndA:
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.
2Y05_A_RALA802_1
(PROSTAGLANDIN
REDUCTASE 1)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		4 / 7 VAL A  76
ASN A 150
GLY A 151
VAL A 156
 None
 0.93A 2y05A-4mndA:
2.6
2y05B-4mndA:
2.8		 2y05A-4mndA:
21.44
2y05B-4mndA:
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.
3IJD_B_C2FB314_0
(UNCHARACTERIZED
PROTEIN)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 12 VAL A 385
ILE A 447
ARG A 446
LEU A 356
ILE A 355
 None
 1.12A 3ijdB-4mndA:
undetectable		 3ijdB-4mndA:
23.09
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.
3KO0_C_TFPC202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 ASP A 296
SER A 300
SER A 308
ILE A 363
GLU A 362
 None
 1.29A 3ko0A-4mndA:
undetectable
3ko0B-4mndA:
undetectable
3ko0C-4mndA:
undetectable
3ko0D-4mndA:
undetectable		 3ko0A-4mndA:
12.84
3ko0B-4mndA:
12.84
3ko0C-4mndA:
12.84
3ko0D-4mndA:
12.84
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.
3KO0_D_TFPD202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 GLU A 362
SER A 308
ILE A 363
ASP A 296
SER A 300
 None
 1.37A 3ko0C-4mndA:
undetectable
3ko0D-4mndA:
undetectable
3ko0E-4mndA:
undetectable
3ko0F-4mndA:
undetectable		 3ko0C-4mndA:
12.84
3ko0D-4mndA:
12.84
3ko0E-4mndA:
12.84
3ko0F-4mndA:
12.84
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.
3KO0_E_TFPE202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 ASP A 296
SER A 300
SER A 308
ILE A 363
GLU A 362
 None
 1.37A 3ko0C-4mndA:
undetectable
3ko0D-4mndA:
undetectable
3ko0E-4mndA:
undetectable
3ko0F-4mndA:
undetectable		 3ko0C-4mndA:
12.84
3ko0D-4mndA:
12.84
3ko0E-4mndA:
12.84
3ko0F-4mndA:
12.84
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.
3KO0_F_TFPF202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 GLU A 362
SER A 308
ILE A 363
ASP A 296
SER A 300
 None
 1.26A 3ko0E-4mndA:
undetectable
3ko0F-4mndA:
undetectable
3ko0G-4mndA:
1.0
3ko0H-4mndA:
undetectable		 3ko0E-4mndA:
12.84
3ko0F-4mndA:
12.84
3ko0G-4mndA:
12.84
3ko0H-4mndA:
12.84
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.
3KO0_G_TFPG202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 10 ASP A 296
SER A 300
SER A 308
ILE A 363
GLU A 362
 None
 1.39A 3ko0E-4mndA:
0.3
3ko0F-4mndA:
undetectable
3ko0G-4mndA:
1.0
3ko0H-4mndA:
undetectable		 3ko0E-4mndA:
12.84
3ko0F-4mndA:
12.84
3ko0G-4mndA:
12.84
3ko0H-4mndA:
12.84
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.
3KO0_H_TFPH202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 12 GLU A 362
SER A 308
ILE A 363
ASP A 296
SER A 300
 None
 1.35A 3ko0G-4mndA:
undetectable
3ko0H-4mndA:
undetectable
3ko0I-4mndA:
undetectable
3ko0J-4mndA:
undetectable		 3ko0G-4mndA:
12.84
3ko0H-4mndA:
12.84
3ko0I-4mndA:
12.84
3ko0J-4mndA:
12.84
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.
3KO0_N_TFPN202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 ASP A 296
SER A 300
GLU A 362
SER A 308
ILE A 363
 None
 1.39A 3ko0K-4mndA:
undetectable
3ko0L-4mndA:
undetectable
3ko0M-4mndA:
undetectable
3ko0N-4mndA:
undetectable		 3ko0K-4mndA:
12.84
3ko0L-4mndA:
12.84
3ko0M-4mndA:
12.84
3ko0N-4mndA:
12.84
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.
3KO0_O_TFPO202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 SER A 308
ILE A 363
GLU A 362
ASP A 296
SER A 300
 None
 1.40A 3ko0O-4mndA:
undetectable
3ko0P-4mndA:
undetectable
3ko0Q-4mndA:
undetectable
3ko0R-4mndA:
undetectable		 3ko0O-4mndA:
12.84
3ko0P-4mndA:
12.84
3ko0Q-4mndA:
12.84
3ko0R-4mndA:
12.84
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.
3KO0_Q_TFPQ202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 10 ASP A 296
SER A 300
SER A 308
ILE A 363
GLU A 362
 None
 1.36A 3ko0O-4mndA:
undetectable
3ko0P-4mndA:
undetectable
3ko0Q-4mndA:
1.1
3ko0R-4mndA:
undetectable		 3ko0O-4mndA:
12.84
3ko0P-4mndA:
12.84
3ko0Q-4mndA:
12.84
3ko0R-4mndA:
12.84
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.
3KO0_R_TFPR202_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 11 GLU A 362
SER A 308
ILE A 363
ASP A 296
SER A 300
 None
 1.37A 3ko0Q-4mndA:
1.1
3ko0R-4mndA:
0.3
3ko0S-4mndA:
0.3
3ko0T-4mndA:
1.0		 3ko0Q-4mndA:
12.84
3ko0R-4mndA:
12.84
3ko0S-4mndA:
12.84
3ko0T-4mndA:
12.84
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.
3M0W_C_P77C203_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		5 / 10 ASP A 296
SER A 300
SER A 308
ILE A 363
GLU A 362
 None
 1.36A 3m0wC-4mndA:
undetectable
3m0wD-4mndA:
undetectable
3m0wE-4mndA:
undetectable
3m0wF-4mndA:
undetectable		 3m0wC-4mndA:
12.66
3m0wD-4mndA:
12.66
3m0wE-4mndA:
12.66
3m0wF-4mndA:
12.66
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.
3M0W_E_P77E203_1
(PROTEIN S100-A4)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		4 / 8 ASP A 386
SER A 335
LEU A 356
ASP A 357
 None
None
None
MG  A 605 (-3.8A)
 0.96A 3m0wE-4mndA:
undetectable
3m0wF-4mndA:
undetectable
3m0wG-4mndA:
undetectable
3m0wH-4mndA:
undetectable		 3m0wE-4mndA:
12.66
3m0wF-4mndA:
12.66
3m0wG-4mndA:
12.66
3m0wH-4mndA:
12.66
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.
6A7J_A_TESA502_0
(CYTOCHROME P450)		 4mnd CTP
L-MYO-INOSITOL-1-PHO
SPHATE
CYTIDYLYLTRANSFERASE
/CDP-L-MYO-INOSITOL
MYO-INOSITOLPHOSPHOT
RANSFERASE
(Archaeoglobus
fulgidus) 		4 / 7 LEU A 469
ALA A 472
ALA A 473
THR A 477
 None
LFA  A 602 ( 4.6A)
None
LFA  A 602 (-3.8A)
 0.57A 6a7jA-4mndA:
undetectable		 6a7jA-4mndA:
13.65