SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4yj1'

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.
1CQE_A_FLPA1650_1
(PROTEIN
(PROSTAGLANDIN H2
SYNTHASE-1))
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A  72
ILE A 207
GLY A 205
ALA A 206
LEU A 194
None
1.01A 1cqeA-4yj1A:
undetectable
1cqeA-4yj1A:
22.51
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.
1CQE_B_FLPB2650_1
(PROTEIN
(PROSTAGLANDIN H2
SYNTHASE-1))
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A  72
ILE A 207
GLY A 205
ALA A 206
LEU A 194
None
1.01A 1cqeB-4yj1A:
undetectable
1cqeB-4yj1A:
22.51
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.
1EQH_A_FLPA701_1
(PROSTAGLANDIN H2
SYNTHASE-1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A  72
ILE A 207
GLY A 205
ALA A 206
LEU A 194
None
1.01A 1eqhA-4yj1A:
0.8
1eqhA-4yj1A:
22.51
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.
1EQH_B_FLPB1701_1
(PROSTAGLANDIN H2
SYNTHASE-1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A  72
ILE A 207
GLY A 205
ALA A 206
LEU A 194
None
0.98A 1eqhB-4yj1A:
undetectable
1eqhB-4yj1A:
22.51
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.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 7 THR A 169
SER A 168
TYR A 143
LEU A 217
None
0.89A 1ibgL-4yj1A:
undetectable
1ibgL-4yj1A:
16.89
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.
1ICR_A_NIOA604_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 SER A 168
THR A 169
PHE A 642
GLU A 630
None
1.18A 1icrA-4yj1A:
undetectable
1icrB-4yj1A:
undetectable
1icrA-4yj1A:
14.94
1icrB-4yj1A:
14.94
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.
1ICR_B_NIOB602_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 GLU A 630
SER A 168
THR A 169
PHE A 642
None
1.19A 1icrA-4yj1A:
undetectable
1icrB-4yj1A:
undetectable
1icrA-4yj1A:
14.94
1icrB-4yj1A:
14.94
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.
1ICU_B_NIOB219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 GLU A 630
SER A 168
THR A 169
PHE A 642
None
1.15A 1icuA-4yj1A:
undetectable
1icuB-4yj1A:
undetectable
1icuA-4yj1A:
14.94
1icuB-4yj1A:
14.94
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.
1ICV_C_NIOC708_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 SER A 168
THR A 169
PHE A 189
GLU A 630
None
1.29A 1icvC-4yj1A:
undetectable
1icvD-4yj1A:
undetectable
1icvC-4yj1A:
14.94
1icvD-4yj1A:
14.94
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.
1ICV_C_NIOC708_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 SER A 168
THR A 169
PHE A 642
GLU A 630
None
1.20A 1icvC-4yj1A:
undetectable
1icvD-4yj1A:
undetectable
1icvC-4yj1A:
14.94
1icvD-4yj1A:
14.94
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.
1ICV_D_NIOD706_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 GLU A 630
SER A 168
THR A 169
PHE A 189
None
1.28A 1icvC-4yj1A:
undetectable
1icvD-4yj1A:
undetectable
1icvC-4yj1A:
14.94
1icvD-4yj1A:
14.94
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.
1ICV_D_NIOD706_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 GLU A 630
SER A 168
THR A 169
PHE A 642
None
1.14A 1icvC-4yj1A:
undetectable
1icvD-4yj1A:
undetectable
1icvC-4yj1A:
14.94
1icvD-4yj1A:
14.94
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.
1KQB_B_BEZB525_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 GLU A 630
SER A 168
THR A 169
PHE A 642
None
1.23A 1kqbA-4yj1A:
undetectable
1kqbB-4yj1A:
undetectable
1kqbA-4yj1A:
16.75
1kqbB-4yj1A:
16.75
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.
1KQB_C_BEZC522_0
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 SER A 168
THR A 169
PHE A 642
GLU A 630
None
1.16A 1kqbC-4yj1A:
undetectable
1kqbD-4yj1A:
undetectable
1kqbC-4yj1A:
16.75
1kqbD-4yj1A:
16.75
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.
1LHV_A_NOGA301_1
(SEX HORMONE-BINDING
GLOBULIN)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 8 ASP A 363
PHE A 380
ASN A 378
LEU A 417
None
1.10A 1lhvA-4yj1A:
undetectable
1lhvA-4yj1A:
15.45
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.
1N13_L_AG2L7014_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 7 LEU A 247
ASP A 345
LEU A 405
ILE A 330
None
1.02A 1n13I-4yj1A:
undetectable
1n13L-4yj1A:
undetectable
1n13I-4yj1A:
9.40
1n13L-4yj1A:
11.87
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.
1P33_A_MTXA351_1
(PTERIDINE REDUCTASE
1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 PHE A 280
LEU A 322
LEU A 304
LEU A 286
PRO A 283
None
1.19A 1p33A-4yj1A:
undetectable
1p33A-4yj1A:
20.43
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.
1Q97_B_ADNB486_1
(SR PROTEIN KINASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 4 VAL A 234
ALA A 131
LEU A 225
PHE A 134
None
1.08A 1q97B-4yj1A:
3.0
1q97B-4yj1A:
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.
1Z11_A_8MOA501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 11 VAL A 256
PHE A 280
THR A 309
ILE A 311
LEU A 322
None
0.94A 1z11A-4yj1A:
undetectable
1z11A-4yj1A:
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.
1Z11_B_8MOB501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 11 VAL A 256
PHE A 280
THR A 309
ILE A 311
LEU A 322
None
0.93A 1z11B-4yj1A:
undetectable
1z11B-4yj1A:
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.
2AYL_B_FLPB2701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A  72
ILE A 207
GLY A 205
ALA A 206
LEU A 194
None
0.98A 2aylB-4yj1A:
undetectable
2aylB-4yj1A:
22.24
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.
2J1G_F_SC2F1290_1
(FICOLIN-2)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 10 SER A 320
ASP A 409
ASP A 411
THR A 412
LYS A 350
ADP  A 701 ( 2.4A)
MG  A 702 ( 4.3A)
MG  A 702 ( 4.2A)
None
None
1.50A 2j1gE-4yj1A:
undetectable
2j1gF-4yj1A:
undetectable
2j1gE-4yj1A:
15.26
2j1gF-4yj1A:
15.26
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.
2J1G_F_SC2F1290_1
(FICOLIN-2)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 10 SER A 320
ASP A 411
THR A 412
GLU A 556
LYS A 350
ADP  A 701 ( 2.4A)
MG  A 702 ( 4.2A)
None
None
None
1.41A 2j1gE-4yj1A:
undetectable
2j1gF-4yj1A:
undetectable
2j1gE-4yj1A:
15.26
2j1gF-4yj1A:
15.26
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.
2JFA_B_RALB600_2
(ESTROGEN RECEPTOR)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 4 LEU A 115
THR A 117
ILE A 235
HIS A 238
None
1.35A 2jfaB-4yj1A:
undetectable
2jfaB-4yj1A:
17.56
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.
2QQD_A_AG2A671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 7 LEU A 247
ASP A 345
LEU A 405
ILE A 330
None
1.06A 2qqdA-4yj1A:
undetectable
2qqdE-4yj1A:
undetectable
2qqdA-4yj1A:
6.17
2qqdE-4yj1A:
12.55
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.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 SER A 320
GLU A 556
ASP A 411
ADP  A 701 ( 2.4A)
None
MG  A 702 ( 4.2A)
0.73A 2zthA-4yj1A:
undetectable
2zthA-4yj1A:
18.35
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.
3BWM_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 SER A 320
GLU A 556
ASP A 411
ADP  A 701 ( 2.4A)
None
MG  A 702 ( 4.2A)
0.79A 3bwmA-4yj1A:
undetectable
3bwmA-4yj1A:
17.99
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.
3BWY_A_SAMA301_1
(COMT PROTEIN)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 SER A 320
GLU A 556
ASP A 411
ADP  A 701 ( 2.4A)
None
MG  A 702 ( 4.2A)
0.79A 3bwyA-4yj1A:
undetectable
3bwyA-4yj1A:
17.36
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.
3CL9_A_MTXA602_2
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 4 VAL A 222
ARG A 102
ILE A  79
THR A 108
None
1.31A 3cl9A-4yj1A:
undetectable
3cl9A-4yj1A:
22.34
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.
3EM4_A_DR7A100_1
(PROTEASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 11 GLY A 619
ALA A 618
ILE A 649
GLY A 652
LEU A 655
None
0.94A 3em4A-4yj1A:
undetectable
3em4A-4yj1A:
10.76
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.
3EM4_V_DR7V100_1
(PROTEASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 11 GLY A 619
ALA A 618
ILE A 649
GLY A 652
LEU A 655
None
0.81A 3em4U-4yj1A:
undetectable
3em4U-4yj1A:
10.76
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.
3G4L_A_ROFA901_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 ASP A 444
LEU A 445
GLN A 404
None
0.76A 3g4lA-4yj1A:
undetectable
3g4lA-4yj1A:
18.46
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.
3KO0_B_TFPB202_2
(PROTEIN S100-A4)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 LEU A 136
SER A 138
PHE A 139
ILE A 188
None
1.00A 3ko0B-4yj1A:
undetectable
3ko0B-4yj1A:
9.84
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.
3N61_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 VAL A 362
VAL A 511
PHE A 609
GLU A 397
None
1.35A 3n61A-4yj1A:
undetectable
3n61B-4yj1A:
undetectable
3n61A-4yj1A:
22.75
3n61B-4yj1A:
22.75
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.
3N8X_B_NIMB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A  72
ILE A 207
GLY A 205
ALA A 206
LEU A 194
None
0.95A 3n8xB-4yj1A:
1.4
3n8xB-4yj1A:
22.24
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.
4DO3_B_0LAB602_1
(FATTY-ACID AMIDE
HYDROLASE 1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 LEU A 326
ILE A 478
MET A 302
THR A 309
None
0.96A 4do3B-4yj1A:
undetectable
4do3B-4yj1A:
23.14
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.
4DO3_B_0LAB602_1
(FATTY-ACID AMIDE
HYDROLASE 1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 LEU A 326
LEU A 322
ILE A 478
MET A 302
None
0.89A 4do3B-4yj1A:
undetectable
4do3B-4yj1A:
23.14
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.
4DTZ_B_LDPB501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 PHE A 210
ALA A 206
ALA A 154
LEU A 194
None
1.01A 4dtzB-4yj1A:
undetectable
4dtzB-4yj1A:
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.
4L9Q_A_9TPA601_1
(SERUM ALBUMIN)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 ALA A 325
ILE A 649
HIS A 648
LEU A 405
GLY A 402
None
1.22A 4l9qA-4yj1A:
undetectable
4l9qA-4yj1A:
21.67
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.
4MWR_A_ZMRA513_1
(NEURAMINIDASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 ARG A 339
ALA A 645
GLU A 560
ARG A 167
ARG A 137
None
1.37A 4mwrA-4yj1A:
undetectable
4mwrA-4yj1A:
20.95
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.
4QZT_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 2)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 PHE A 521
THR A 586
LEU A 655
None
0.60A 4qztA-4yj1A:
undetectable
4qztA-4yj1A:
12.23
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.
4XUD_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 SER A 320
GLU A 556
ASP A 411
ADP  A 701 ( 2.4A)
None
MG  A 702 ( 4.2A)
0.75A 4xudA-4yj1A:
undetectable
4xudA-4yj1A:
17.99
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.
4YB6_E_HISE302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 10 MET A 396
LEU A 408
SER A 403
LEU A 399
VAL A 451
None
1.36A 4yb6D-4yj1A:
undetectable
4yb6E-4yj1A:
undetectable
4yb6D-4yj1A:
20.10
4yb6E-4yj1A:
20.10
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.
5FCT_B_C2FB402_0
(THYMIDYLATE SYNTHASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 VAL A  61
ILE A 207
LEU A 214
CYH A  85
ALA A 154
None
1.27A 5fctB-4yj1A:
undetectable
5fctB-4yj1A:
21.84
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.
5G5G_A_ACTA1231_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGR
MOLYBDENUM-BINDING
SU SUBUNIT
PUTATIVE XANTHINE
DEHYDROGENASE YAGT
IRON-SULFUR-BINDING
SUBUNIT)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 ARG A 606
THR A 347
ASP A 345
None
0.95A 5g5gA-4yj1A:
undetectable
5g5gB-4yj1A:
undetectable
5g5gA-4yj1A:
16.89
5g5gB-4yj1A:
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.
5HRQ_I_IPHI101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 VAL A 234
HIS A 231
LEU A 230
LEU A 115
None
1.17A 5hrqB-4yj1A:
undetectable
5hrqI-4yj1A:
undetectable
5hrqJ-4yj1A:
undetectable
5hrqB-4yj1A:
5.27
5hrqI-4yj1A:
3.11
5hrqJ-4yj1A:
5.27
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.
5HWA_A_GCSA303_1
(CHITOSANASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 5 ASP A 626
HIS A 625
GLY A 619
ALA A 618
None
1.00A 5hwaA-4yj1A:
undetectable
5hwaA-4yj1A:
17.99
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.
5JWA_H_ACTH612_0
(NADH DEHYDROGENASE,
PUTATIVE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 ARG A 191
PRO A 639
ASN A 565
None
0.96A 5jwaA-4yj1A:
undetectable
5jwaH-4yj1A:
undetectable
5jwaA-4yj1A:
20.69
5jwaH-4yj1A:
20.69
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.
5L17_A_ZMRA512_1
(NEURAMINIDASE)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 ARG A 339
ALA A 645
GLU A 560
ARG A 167
ARG A 137
None
1.38A 5l17A-4yj1A:
undetectable
5l17A-4yj1A:
20.80
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.
5NWV_A_ACAA18_1
(SCRFP-TAG,GP41)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
5 / 12 LEU A 304
GLY A 307
SER A 452
LEU A 408
LEU A 406
None
1.08A 5nwvA-4yj1A:
undetectable
5nwvA-4yj1A:
5.24
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.
5VCE_A_RITA602_2
(CYTOCHROME P450 3A4)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 6 ARG A 127
ARG A 128
PHE A 134
ILE A 186
None
1.02A 5vceA-4yj1A:
undetectable
5vceA-4yj1A:
21.30
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)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 8 GLY A 599
ARG A 137
VAL A 129
ASP A 133
None
0.92A 5vlmA-4yj1A:
undetectable
5vlmA-4yj1A:
16.64
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.
5VLM_F_CVIF301_1
(REGULATORY PROTEIN
TETR)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
4 / 8 ILE A 649
ARG A 647
GLN A 563
VAL A 555
None
1.03A 5vlmF-4yj1A:
undetectable
5vlmF-4yj1A:
16.64
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.
6DWD_D_GLYD713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei)
3 / 3 ARG A 137
HIS A 140
ARG A 144
None
1.09A 6dwdD-4yj1A:
undetectable
6dwdD-4yj1A:
21.92