SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1ml4'

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.
1A7Y_B_DVAB2_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.86A 1a7yB-1ml4A:
undetectable		 1a7yB-1ml4A:
3.48
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.
1D4F_D_ADND604_2
(S-ADENOSYLHOMOCYSTEI
NE HYDROLASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 THR A 145
THR A 169
HIS A 135
HIS A 266
 None
PAL  A 385 ( 4.2A)
PAL  A 385 (-3.9A)
None
 1.41A 1d4fD-1ml4A:
3.2		 1d4fD-1ml4A:
23.97
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.
1DSC_C_DVAC2_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.97A 1dscC-1ml4A:
undetectable		 1dscC-1ml4A:
3.48
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.
1DSC_C_DVAC8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.71A 1dscC-1ml4A:
undetectable		 1dscC-1ml4A:
3.48
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.
1FJA_C_DVAC8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.85A 1fjaC-1ml4A:
undetectable		 1fjaC-1ml4A:
3.48
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.
1FJA_D_DVAD8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.86A 1fjaD-1ml4A:
undetectable		 1fjaD-1ml4A:
3.48
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.
1I3W_E_DVAE8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.87A 1i3wE-1ml4A:
undetectable		 1i3wE-1ml4A:
3.48
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.
1I3W_G_DVAG8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.83A 1i3wG-1ml4A:
undetectable		 1i3wG-1ml4A:
3.48
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.
1I3W_H_DVAH8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.84A 1i3wH-1ml4A:
undetectable		 1i3wH-1ml4A:
3.48
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.
1JO4_A_DVAA6_0
(GRAMICIDIN C)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.93A 1jo4A-1ml4A:
undetectable		 1jo4A-1ml4A:
6.45
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.
1JO4_B_DVAB6_0
(GRAMICIDIN C)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.93A 1jo4B-1ml4A:
undetectable		 1jo4B-1ml4A:
6.45
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.
1MNV_D_DVAD2_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.86A 1mnvD-1ml4A:
undetectable		 1mnvD-1ml4A:
3.48
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.
1MNV_D_DVAD8_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.80A 1mnvD-1ml4A:
undetectable		 1mnvD-1ml4A:
3.48
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.
1NH8_A_HISA289_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 ASP A 142
LEU A  23
ALA A 176
LEU A 173
 None
 1.04A 1nh8A-1ml4A:
1.6		 1nh8A-1ml4A:
24.64
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.
1NRM_A_DVAA6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.86A 1nrmA-1ml4A:
undetectable		 1nrmA-1ml4A:
3.67
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.
1NRM_B_DVAB6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.86A 1nrmB-1ml4A:
undetectable		 1nrmB-1ml4A:
3.67
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.
1NRU_A_DVAA6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.92A 1nruA-1ml4A:
undetectable		 1nruA-1ml4A:
3.67
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.
1NRU_B_DVAB6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.92A 1nruB-1ml4A:
undetectable		 1nruB-1ml4A:
3.67
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.
1NT5_A_DVAA6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.71A 1nt5A-1ml4A:
undetectable		 1nt5A-1ml4A:
3.74
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.
1NT5_A_DVAA6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 302
VAL A 304
TRP A   3
 None
 0.81A 1nt5A-1ml4A:
undetectable		 1nt5A-1ml4A:
3.74
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.
1NT5_B_DVAB6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 299
VAL A 304
TRP A   3
 None
 0.71A 1nt5B-1ml4A:
undetectable		 1nt5B-1ml4A:
3.74
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.
1NT5_B_DVAB6_0
(GRAMICIDIN A)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ALA A 302
VAL A 304
TRP A   3
 None
 0.81A 1nt5B-1ml4A:
undetectable		 1nt5B-1ml4A:
3.74
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.
1PKV_A_RBFA100_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 THR A 214
ILE A 187
THR A 212
ILE A 219
VAL A 218
 None
 1.04A 1pkvA-1ml4A:
undetectable
1pkvB-1ml4A:
undetectable		 1pkvA-1ml4A:
16.23
1pkvB-1ml4A:
16.23
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.
1PKV_B_RBFB101_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 ILE A 219
VAL A 218
THR A 214
ILE A 187
THR A 212
 None
 1.07A 1pkvA-1ml4A:
undetectable
1pkvB-1ml4A:
undetectable		 1pkvA-1ml4A:
16.23
1pkvB-1ml4A:
16.23
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_B_FUAB703_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 12 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.22A 1q23B-1ml4A:
0.5		 1q23B-1ml4A:
22.52
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.
1Q23_C_FUAC701_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 12 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.22A 1q23C-1ml4A:
undetectable		 1q23C-1ml4A:
22.52
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.
1Q23_E_FUAE706_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 10 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.24A 1q23E-1ml4A:
0.5		 1q23E-1ml4A:
22.52
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.
1Q23_I_FUAI707_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.17A 1q23I-1ml4A:
0.3		 1q23I-1ml4A:
22.52
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.
1Q23_J_FUAJ711_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.17A 1q23J-1ml4A:
0.5		 1q23J-1ml4A:
22.52
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.
1Q23_K_FUAK712_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 10 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.19A 1q23K-1ml4A:
0.3		 1q23K-1ml4A:
22.52
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.
1Q23_L_FUAL710_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 SER A 172
PHE A  62
LEU A 300
VAL A  22
VAL A   8
 None
 1.22A 1q23L-1ml4A:
undetectable		 1q23L-1ml4A:
22.52
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.
1UNJ_L_DVAL2_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.86A 1unjL-1ml4A:
undetectable		 1unjL-1ml4A:
3.48
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.
1UNJ_L_DVAL8_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.82A 1unjL-1ml4A:
undetectable		 1unjL-1ml4A:
3.48
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.
1UNJ_R_DVAR2_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.83A 1unjR-1ml4A:
undetectable		 1unjR-1ml4A:
3.48
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.
1UNJ_R_DVAR8_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.82A 1unjR-1ml4A:
undetectable		 1unjR-1ml4A:
3.48
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.
1UNJ_W_DVAW8_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.82A 1unjW-1ml4A:
undetectable		 1unjW-1ml4A:
3.48
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.
1UNJ_X_DVAX2_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.82A 1unjX-1ml4A:
undetectable		 1unjX-1ml4A:
3.48
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.
1UNJ_X_DVAX8_0
(7-AMINO-ACTINOMYCIN
D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.82A 1unjX-1ml4A:
undetectable		 1unjX-1ml4A:
3.48
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.
1UNM_E_DVAE2_0
(7-AMINOACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.84A 1unmE-1ml4A:
undetectable		 1unmE-1ml4A:
3.48
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.
1UNM_E_DVAE8_0
(7-AMINOACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.82A 1unmE-1ml4A:
undetectable		 1unmE-1ml4A:
3.48
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.
1UNM_F_DVAF2_0
(7-AMINOACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.84A 1unmF-1ml4A:
undetectable		 1unmF-1ml4A:
3.48
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.
1UNM_F_DVAF8_0
(7-AMINOACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 137
THR A 139
PRO A 136
 None
 0.79A 1unmF-1ml4A:
undetectable		 1unmF-1ml4A:
3.48
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.
2E1Q_D_SALD5006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 ARG A 107
PHE A  51
THR A  58
LEU A  60
 PAL  A 385 (-2.8A)
None
PAL  A 385 (-3.7A)
None
 1.39A 2e1qD-1ml4A:
undetectable		 2e1qD-1ml4A:
13.11
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.
2QAK_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 ARG A 270
THR A 281
VAL A 278
 None
 0.99A 2qakA-1ml4A:
undetectable		 2qakA-1ml4A:
14.33
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.
2Y00_A_Y00A601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 12 LEU A 300
VAL A 296
TRP A   3
ASP A  18
PHE A 179
 None
 1.48A 2y00A-1ml4A:
undetectable		 2y00A-1ml4A:
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.
2Y00_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 12 LEU A 300
VAL A 296
TRP A   3
ASP A  18
PHE A 179
 None
 1.50A 2y00B-1ml4A:
undetectable		 2y00B-1ml4A:
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.
2Y01_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 12 LEU A 300
VAL A 296
TRP A   3
ASP A  18
PHE A 179
 None
 1.46A 2y01B-1ml4A:
undetectable		 2y01B-1ml4A:
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.
3DEU_A_SALA305_1
(TRANSCRIPTIONAL
REGULATOR SLYA)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 7 THR A  93
VAL A  97
ILE A 104
ILE A 106
 None
 0.86A 3deuA-1ml4A:
undetectable		 3deuA-1ml4A:
21.86
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.
3JWQ_D_VIAD901_1
(CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
CATALYTIC DOMAIN,
CONE CGMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE
SUBUNIT ALPHA
CHIMERA)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 HIS A 135
LEU A 140
ALA A 114
PHE A  62
LEU A  47
 PAL  A 385 (-3.9A)
None
None
None
None
 1.46A 3jwqA-1ml4A:
undetectable
3jwqD-1ml4A:
undetectable		 3jwqA-1ml4A:
22.10
3jwqD-1ml4A:
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.
4HIV_D_DVAD2_0
(ACTINOMYCIN D)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		3 / 3 THR A 139
PRO A 136
THR A 137
 None
 0.88A 4hivD-1ml4A:
undetectable		 4hivD-1ml4A:
3.48
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.
4LVC_A_ADNA501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.39A 4lvcA-1ml4A:
4.8		 4lvcA-1ml4A:
23.13
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.
4LVC_C_ADNC501_2
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.38A 4lvcC-1ml4A:
2.2		 4lvcC-1ml4A:
23.13
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.
4WQL_A_KANA203_1
(2''-AMINOGLYCOSIDE
NUCLEOTIDYLTRANSFERA
SE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 9 ASP A 272
TYR A 241
ASP A 163
TYR A 166
GLU A 233
 None
 1.22A 4wqlA-1ml4A:
0.0		 4wqlA-1ml4A:
20.20
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.
5B1A_J_CHDJ102_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 7 ILE A 104
LEU A  50
ARG A 115
LEU A  90
 None
 0.86A 5b1aA-1ml4A:
0.0
5b1aJ-1ml4A:
undetectable		 5b1aA-1ml4A:
21.77
5b1aJ-1ml4A:
13.01
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.
5B3S_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 7 ILE A 104
LEU A  50
ARG A 115
LEU A  90
 None
 0.86A 5b3sA-1ml4A:
0.0
5b3sJ-1ml4A:
undetectable		 5b3sA-1ml4A:
21.77
5b3sJ-1ml4A:
13.01
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.
5CFS_A_TOYA203_1
(AAD(2''),GENTAMICIN
2''-NUCLEOTIDYLTRANS
FERASE,GENTAMICIN
RESISTANCE PROTEIN)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 8 ASP A 272
TYR A 241
ASP A 163
TYR A 166
 None
 1.04A 5cfsA-1ml4A:
0.0		 5cfsA-1ml4A:
18.97
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.
5LF7_V_6V8V303_0
(PROTEASOME SUBUNIT
BETA TYPE-3
PROTEASOME SUBUNIT
BETA TYPE-7)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 11 ALA A 174
GLY A 167
THR A 228
ASP A 142
LEU A 141
 None
 1.11A 5lf7V-1ml4A:
undetectable
5lf7W-1ml4A:
undetectable		 5lf7V-1ml4A:
23.64
5lf7W-1ml4A:
19.74
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.
5M5K_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 4 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.42A 5m5kA-1ml4A:
2.1		 5m5kA-1ml4A:
23.13
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.
5M5K_C_ADNC502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 4 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.40A 5m5kC-1ml4A:
4.8		 5m5kC-1ml4A:
23.13
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.
5M66_B_ADNB502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 4 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.42A 5m66B-1ml4A:
2.2		 5m66B-1ml4A:
23.13
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.
5N5D_B_SAMB303_0
(METHYLTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 12 LEU A 301
ALA A 299
VAL A 296
ILE A   9
ALA A 114
 None
 1.08A 5n5dB-1ml4A:
4.6		 5n5dB-1ml4A:
25.32
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.
5OG9_A_TESA503_1
(-)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 9 LEU A 184
VAL A 170
LEU A 160
ILE A 146
MET A 265
 None
 1.35A 5og9A-1ml4A:
0.0		 5og9A-1ml4A:
21.28
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.
5ZCP_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 7 ILE A 104
LEU A  50
ARG A 115
LEU A  90
 None
 0.89A 5zcpA-1ml4A:
0.0
5zcpJ-1ml4A:
undetectable		 5zcpA-1ml4A:
21.77
5zcpJ-1ml4A:
13.01
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.
5ZCQ_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 7 ILE A 104
LEU A  50
ARG A 115
LEU A  90
 None
 0.87A 5zcqA-1ml4A:
0.0
5zcqJ-1ml4A:
undetectable		 5zcqA-1ml4A:
21.77
5zcqJ-1ml4A:
13.01
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 7 SER A  55
HIS A 135
GLY A 129
ARG A 297
 PAL  A 385 (-2.6A)
PAL  A 385 (-3.9A)
None
None
 1.10A 6btxA-1ml4A:
0.0		 6btxA-1ml4A:
24.94
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_BEZA401_0
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		5 / 9 LEU A 143
THR A 139
ILE A  11
PHE A  14
ILE A  19
 None
 1.30A 6ef6A-1ml4A:
undetectable		 6ef6A-1ml4A:
21.10
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.
6F3M_B_ADNB502_2
(-)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 4 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.47A 6f3mB-1ml4A:
9.7		 6f3mB-1ml4A:
22.54
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.
6GBN_A_ADNA501_2
(-)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.39A 6gbnA-1ml4A:
6.2		 6gbnA-1ml4A:
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.
6GBN_D_ADND501_2
(-)		 1ml4 ASPARTATE
TRANSCARBAMOYLASE
(Pyrococcus
abyssi) 		4 / 5 GLN A 138
THR A 137
THR A  49
LEU A  60
 PAL  A 385 (-4.7A)
None
None
None
 1.39A 6gbnD-1ml4A:
4.4		 6gbnD-1ml4A:
22.10