SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2x0s'

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.
1KNY_A_KANA558_1
(KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 7 SER A 779
ASP A 778
GLU A 736
GLU A 737
 None
 1.20A 1knyA-2x0sA:
2.4
1knyB-2x0sA:
undetectable		 1knyA-2x0sA:
14.08
1knyB-2x0sA:
14.08
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.
1KNY_B_KANB559_1
(KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 8 SER A 779
ASP A 778
GLU A 736
GLU A 737
 None
 1.07A 1knyA-2x0sA:
2.4
1knyB-2x0sA:
undetectable		 1knyA-2x0sA:
14.08
1knyB-2x0sA:
14.08
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.
1MJO_D_SAMD200_0
(METHIONINE REPRESSOR)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 9 ARG A 898
ARG A 899
LEU A 393
GLU A 390
ALA A 391
 None
 1.41A 1mjoC-2x0sA:
undetectable		 1mjoC-2x0sA:
8.18
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.
1RH3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 ILE A 549
SER A 894
ILE A 895
ARG A 899
LEU A 393
 None
 1.25A 1rh3A-2x0sA:
undetectable		 1rh3A-2x0sA:
9.78
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.
2AVV_A_MK1A901_2
(POL POLYPROTEIN)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		3 / 3 ASP A 355
VAL A 247
PRO A  43
 None
 0.77A 2avvA-2x0sA:
undetectable		 2avvA-2x0sA:
8.31
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.
2DYS_W_CHDW101_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 LEU A 648
ARG A 596
THR A 587
LEU A 644
 None
 1.06A 2dysN-2x0sA:
undetectable
2dysW-2x0sA:
undetectable		 2dysN-2x0sA:
18.80
2dysW-2x0sA:
4.54
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.
2NYR_B_SVRB401_3
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 ARG A 488
ILE A 376
PHE A 261
GLY A 274
ASN A 296
 None
 1.41A 2nyrB-2x0sA:
undetectable		 2nyrB-2x0sA:
13.84
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.
2RLF_D_RIMD499_1
(MATRIX PROTEIN 2)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 ILE A 701
ARG A 612
LEU A 616
LEU A 694
 None
 1.07A 2rlfA-2x0sA:
undetectable
2rlfD-2x0sA:
undetectable		 2rlfA-2x0sA:
4.37
2rlfD-2x0sA:
4.37
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.
2TCT_A_CTCA222_0
(TETRACYCLINE
REPRESSOR)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 PHE A 786
ARG A 642
PRO A 730
VAL A 732
ILE A 768
 None
 1.50A 2tctA-2x0sA:
1.0		 2tctA-2x0sA:
12.31
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.
2V7U_B_SAMB1299_1
(5'-FLUORO-5'-DEOXY
ADENOSINE SYNTHETASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 7 ASP A 345
ASN A 365
SER A 262
ARG A 263
 None
 1.34A 2v7uB-2x0sA:
undetectable		 2v7uB-2x0sA:
15.48
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.
2XKK_E_MFXE1100_1
(TOPOISOMERASE IV
DNA)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		3 / 3 ARG A 538
GLU A 413
SER A 539
 None
 0.92A 2xkkA-2x0sA:
undetectable
2xkkC-2x0sA:
undetectable		 2xkkA-2x0sA:
22.85
2xkkC-2x0sA:
22.85
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.
2YOE_C_FL7C1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 8 GLY A 688
ILE A 701
VAL A 729
THR A 697
 None
 0.91A 2yoeB-2x0sA:
undetectable
2yoeC-2x0sA:
undetectable		 2yoeB-2x0sA:
16.74
2yoeC-2x0sA:
16.74
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.
3F33_A_PFLA2001_1
(FERRITIN LIGHT CHAIN)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 SER A 526
LEU A 423
ARG A 421
LEU A 473
 None
 0.92A 3f33A-2x0sA:
undetectable		 3f33A-2x0sA:
11.95
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.
3G4L_D_ROFD904_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4D)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		3 / 3 ASN A 116
MET A 246
PHE A 141
 None
 1.08A 3g4lD-2x0sA:
undetectable		 3g4lD-2x0sA:
17.23
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.
3IA4_B_MTXB164_1
(DIHYDROFOLATE
REDUCTASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 ILE A 549
SER A 894
ILE A 895
ARG A 899
LEU A 393
 None
 1.15A 3ia4B-2x0sA:
undetectable		 3ia4B-2x0sA:
10.93
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.
3KMO_B_EAAB213_1
(GLUTATHIONE
S-TRANSFERASE P)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 7 PHE A   9
VAL A  35
ASN A  13
GLY A  11
 None
 1.00A 3kmoB-2x0sA:
undetectable		 3kmoB-2x0sA:
12.92
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.
3KU1_H_SAMH226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 GLY A 258
GLY A 274
ALA A 256
LEU A 332
ILE A 295
 None
 1.06A 3ku1H-2x0sA:
1.8		 3ku1H-2x0sA:
13.72
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.
3O02_B_JN3B1_1
(CELL INVASION
PROTEIN SIPD)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 10 ILE A 523
ALA A 430
LEU A 408
ASN A 407
LEU A 535
 None
 1.22A 3o02A-2x0sA:
undetectable
3o02B-2x0sA:
undetectable		 3o02A-2x0sA:
15.63
3o02B-2x0sA:
15.63
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.
3S56_B_ROCB203_1
(PROTEASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 7 GLU A  33
LEU A 339
PRO A  40
ILE A  39
 None
 0.94A 3s56B-2x0sA:
undetectable		 3s56B-2x0sA:
8.68
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.
3TKD_A_CYZA266_2
(GLUTAMATE RECEPTOR 2)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 5 ILE A 419
SER A 526
LYS A 527
GLY A 528
 None
 1.15A 3tkdB-2x0sA:
undetectable		 3tkdB-2x0sA:
14.74
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.
3TKD_B_CYZB267_1
(GLUTAMATE RECEPTOR 2)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 5 ILE A 419
SER A 526
LYS A 527
GLY A 528
 None
 1.16A 3tkdA-2x0sA:
undetectable		 3tkdA-2x0sA:
14.74
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.
4AC9_C_DXCC1477_0
(MJ0495-LIKE PROTEIN)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 THR A 795
GLY A 798
ARG A 690
LEU A 835
 None
 1.24A 4ac9C-2x0sA:
2.8		 4ac9C-2x0sA:
21.37
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.
4ACA_C_DXCC1477_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 THR A 795
GLY A 798
ARG A 690
LEU A 835
 None
 1.22A 4acaC-2x0sA:
2.8		 4acaC-2x0sA:
21.37
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.
4HFP_B_15UB402_1
(PROTHROMBIN)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 TYR A 398
ALA A 889
ILE A 827
GLY A 859
GLY A 856
 None
 1.11A 4hfpB-2x0sA:
undetectable		 4hfpB-2x0sA:
13.41
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.
4L6V_1_PQN12001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 11 GLY A 525
ALA A 425
LEU A 423
GLY A 422
ALA A 280
 None
 1.14A 4l6v1-2x0sA:
undetectable
4l6v6-2x0sA:
1.8		 4l6v1-2x0sA:
22.45
4l6v6-2x0sA:
10.87
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.
4OKB_A_198A1002_2
(ANDROGEN RECEPTOR)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 LEU A 332
ASN A 328
LEU A 360
VAL A 247
 None
 1.20A 4okbA-2x0sA:
undetectable		 4okbA-2x0sA:
13.65
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.
4R29_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 ARG A 488
ALA A 425
SER A 496
MET A 490
GLY A 491
 None
 1.26A 4r29A-2x0sA:
undetectable		 4r29A-2x0sA:
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.
4UIN_H_QI9H1226_0
(FAB 314.3)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 12 SER A 426
GLY A 268
ARG A 368
PHE A 261
GLY A 366
 None
 1.42A 4uinH-2x0sA:
undetectable
4uinL-2x0sA:
undetectable		 4uinH-2x0sA:
12.49
4uinL-2x0sA:
14.23
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.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		5 / 8 ALA A 469
VAL A 435
GLY A 471
ALA A 430
GLY A 432
 None
 1.46A 4zjzB-2x0sA:
undetectable		 4zjzB-2x0sA:
20.34
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.
5IWU_A_ACTA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 6 PHE A 436
VAL A 434
TYR A 520
MET A 501
 None
 1.24A 5iwuA-2x0sA:
undetectable		 5iwuA-2x0sA:
15.55
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.
5J6H_A_NCAA402_0
(H-2 CLASS I
HISTOCOMPATIBILITY
ANTIGEN, Q10 ALPHA
CHAIN)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		3 / 3 PRO A 646
ARG A 690
GLU A 588
 None
 0.98A 5j6hA-2x0sA:
undetectable		 5j6hA-2x0sA:
15.99
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.
5JS5_A_ASCA202_0
(CYTOCHROME C')		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		3 / 3 CYH A 868
LYS A 870
HIS A 869
 None
 1.21A 5js5A-2x0sA:
undetectable		 5js5A-2x0sA:
8.92
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.
5KB5_A_ADNA401_2
(ADENOSINE KINASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 4 ASN A 112
LEU A  92
SER A  94
LEU A 208
 None
 1.35A 5kb5A-2x0sA:
undetectable		 5kb5A-2x0sA:
17.05
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.
5KOX_A_RFPA502_2
(PENTACHLOROPHENOL
4-MONOOXYGENASE)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		3 / 3 VAL A 883
ARG A 632
PRO A 568
 None
 0.86A 5koxA-2x0sA:
undetectable		 5koxA-2x0sA:
20.61
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.
5XDH_B_DAHB60_1
(PUTATIVE CYTOCHROME
C)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 5 MET A 852
ASN A 564
VAL A 876
LEU A 873
 None
 1.31A 5xdhB-2x0sA:
0.5		 5xdhB-2x0sA:
6.17
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.
5XDH_D_DAHD60_1
(PUTATIVE CYTOCHROME
C)		 2x0s PYRUVATE PHOSPHATE
DIKINASE
(Trypanosoma
brucei) 		4 / 5 MET A 852
ASN A 564
VAL A 876
LEU A 873
 None
 1.25A 5xdhD-2x0sA:
undetectable		 5xdhD-2x0sA:
6.17