SIMILAR PATTERNS OF AMINO ACIDS FOR 3KP6_A_SALA3002_1

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1aoa T-FIMBRIN

(Homo sapiens) 		PF00307
(CH) 		5 LEU A 201
VAL A 227
LEU A 230
VAL A 160
LEU A 166
 LEU  A 201 ( 0.6A)
VAL  A 227 ( 0.6A)
LEU  A 230 ( 0.6A)
VAL  A 160 ( 0.6A)
LEU  A 166 ( 0.6A)
 1.15A 3kp6A-1aoaA:
0.0
3kp6B-1aoaA:
0.0		 3kp6A-1aoaA:
21.77
3kp6B-1aoaA:
21.77
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.
1aol GP70

(Murine leukemia
virus) 		PF00429
(TLV_coat) 		5 LEU A  48
VAL A 165
LEU A 187
VAL A 120
LEU A 209
 None
 1.29A 3kp6A-1aolA:
undetectable
3kp6B-1aolA:
0.0		 3kp6A-1aolA:
19.67
3kp6B-1aolA:
19.67
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.
1awb MYO-INOSITOL
MONOPHOSPHATASE

(Homo sapiens) 		PF00459
(Inositol_P) 		5 HIS A 217
VAL A 250
ILE A 216
VAL A 221
LEU A 245
 None
None
IPD  A 281 (-4.9A)
None
None
 1.42A 3kp6A-1awbA:
undetectable
3kp6B-1awbA:
0.0		 3kp6A-1awbA:
19.42
3kp6B-1awbA:
19.42
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.
1c30 CARBAMOYL PHOSPHATE
SYNTHETASE: LARGE
SUBUNIT

(Escherichia
coli) 		PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3) 		5 LEU A 335
LEU A 326
ILE A 319
VAL A 221
LEU A 332
 None
 1.37A 3kp6A-1c30A:
0.8
3kp6B-1c30A:
0.0		 3kp6A-1c30A:
9.86
3kp6B-1c30A:
9.86
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.
1cj0 PROTEIN (SERINE
HYDROXYMETHYLTRANSFE
RASE)

(Oryctolagus
cuniculus) 		PF00464
(SHMT) 		5 VAL A 105
LEU A 109
ILE A 239
VAL A 222
LEU A2501
 None
 1.19A 3kp6A-1cj0A:
undetectable
3kp6B-1cj0A:
0.0		 3kp6A-1cj0A:
14.98
3kp6B-1cj0A:
14.98
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.
1cz4 VCP-LIKE ATPASE

(Thermoplasma
acidophilum) 		PF02359
(CDC48_N)
PF02933
(CDC48_2) 		5 VAL A  24
LEU A  26
ILE A  44
VAL A  87
LEU A   9
 None
 1.37A 3kp6A-1cz4A:
undetectable
3kp6B-1cz4A:
undetectable		 3kp6A-1cz4A:
21.58
3kp6B-1cz4A:
21.58
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.
1czi CHYMOSIN

(Bos taurus) 		PF00026
(Asp) 		5 LEU E 301
VAL E 197
ILE E 231
VAL E 258
LEU E 269
 None
 1.28A 3kp6A-1cziE:
0.0
3kp6B-1cziE:
undetectable		 3kp6A-1cziE:
17.87
3kp6B-1cziE:
17.87
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.
1dbn PROTEIN
(LEUKOAGGLUTININ)

(Maackia
amurensis) 		PF00139
(Lectin_legB) 		5 VAL A 201
LEU A 182
ILE A 206
VAL A 124
LEU A  93
 None
 1.39A 3kp6A-1dbnA:
undetectable
3kp6B-1dbnA:
undetectable		 3kp6A-1dbnA:
23.20
3kp6B-1dbnA:
23.20
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.
1dcn DELTA 2 CRYSTALLIN

(Anas
platyrhynchos) 		PF00206
(Lyase_1)
PF14698
(ASL_C2) 		5 LEU A 273
LEU A 295
ILE A 352
VAL A 351
LEU A 275
 None
 1.24A 3kp6A-1dcnA:
0.0
3kp6B-1dcnA:
0.0		 3kp6A-1dcnA:
17.70
3kp6B-1dcnA:
17.70
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.
1dcz TRANSCARBOXYLASE
1.3S SUBUNIT

(Propionibacterium
freudenreichii) 		PF00364
(Biotin_lipoyl) 		5 VAL A 107
LEU A 119
ILE A  68
VAL A  65
LEU A  85
 None
 1.28A 3kp6A-1dczA:
undetectable
3kp6B-1dczA:
undetectable		 3kp6A-1dczA:
23.73
3kp6B-1dczA:
23.73
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.
1e0k DNA HELICASE

(Escherichia
virus T7) 		PF03796
(DnaB_C) 		5 HIS A 465
VAL A 322
ILE A 463
VAL A 310
LEU A 502
 None
 1.30A 3kp6A-1e0kA:
0.0
3kp6B-1e0kA:
undetectable		 3kp6A-1e0kA:
21.18
3kp6B-1e0kA:
21.18
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.
1e8a S100A12

(Homo sapiens) 		PF01023
(S_100) 		5 LEU A  35
VAL A  77
LEU A  76
ILE A  10
LEU A  40
 None
 1.29A 3kp6A-1e8aA:
undetectable
3kp6B-1e8aA:
undetectable		 3kp6A-1e8aA:
24.50
3kp6B-1e8aA:
24.50
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.
1ea6 PMS1 PROTEIN HOMOLOG
2

(Homo sapiens) 		PF01119
(DNA_mis_repair)
PF13589
(HATPase_c_3) 		5 VAL A 120
LEU A 114
ILE A 122
VAL A 157
LEU A  42
 None
 1.30A 3kp6A-1ea6A:
undetectable
3kp6B-1ea6A:
undetectable		 3kp6A-1ea6A:
19.09
3kp6B-1ea6A:
19.09
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.
1ej6 LAMBDA1

(Reovirus sp.) 		no annotation 5 LEU B 988
VAL B 928
LEU B 931
ILE B 520
ARG B 851
 None
 1.22A 3kp6A-1ej6B:
0.0
3kp6B-1ej6B:
0.5		 3kp6A-1ej6B:
8.26
3kp6B-1ej6B:
8.26
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.
1fpz CYCLIN-DEPENDENT
KINASE INHIBITOR 3

(Homo sapiens) 		PF05706
(CDKN3) 		5 LEU A  32
LEU A 154
ILE A 162
VAL A  37
LEU A  34
 None
 1.34A 3kp6A-1fpzA:
undetectable
3kp6B-1fpzA:
undetectable		 3kp6A-1fpzA:
21.50
3kp6B-1fpzA:
21.50
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.
1fs2 SKP2

(Homo sapiens) 		PF12937
(F-box-like) 		5 LEU A 247
LEU A 275
ILE A 297
VAL A 293
LEU A 264
 None
 0.94A 3kp6A-1fs2A:
undetectable
3kp6B-1fs2A:
undetectable		 3kp6A-1fs2A:
19.41
3kp6B-1fs2A:
19.41
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.
1g3m ESTROGEN
SULFOTRANSFERASE

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		5 HIS A 224
VAL A 203
ILE A 223
VAL A 219
LEU A 218
 None
 1.29A 3kp6A-1g3mA:
undetectable
3kp6B-1g3mA:
undetectable		 3kp6A-1g3mA:
20.21
3kp6B-1g3mA:
20.21
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.
1gvz KALLIKREIN-1E2

(Equus caballus) 		PF00089
(Trypsin) 		5 VAL A  47
LEU A  46
ILE A 242
ARG A 107
LEU A 108
 None
None
ACT  A1250 ( 4.1A)
None
None
 1.28A 3kp6A-1gvzA:
undetectable
3kp6B-1gvzA:
undetectable		 3kp6A-1gvzA:
17.99
3kp6B-1gvzA:
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.
1gz7 LIPASE 2

(Diutina rugosa) 		PF00135
(COesterase) 		5 HIS A 449
LEU A 347
ILE A  86
VAL A  81
LEU A 445
 None
 1.40A 3kp6A-1gz7A:
undetectable
3kp6B-1gz7A:
undetectable		 3kp6A-1gz7A:
15.94
3kp6B-1gz7A:
15.94
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.
1h2t 80 KDA NUCLEAR CAP
BINDING PROTEIN

(Homo sapiens) 		PF02854
(MIF4G)
PF09088
(MIF4G_like)
PF09090
(MIF4G_like_2) 		5 HIS C 585
LEU C 576
VAL C 524
LEU C 521
VAL C 546
 None
 1.21A 3kp6A-1h2tC:
undetectable
3kp6B-1h2tC:
undetectable		 3kp6A-1h2tC:
11.69
3kp6B-1h2tC:
11.69
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.
1ha5 STREPTOCOCCAL
PYOGENIC EXOTOXIN A1

(Streptococcus
pyogenes) 		PF01123
(Stap_Strp_toxin)
PF02876
(Stap_Strp_tox_C) 		5 LEU A1129
VAL A1149
LEU A1153
VAL A1216
LEU A1218
 None
 1.38A 3kp6A-1ha5A:
undetectable
3kp6B-1ha5A:
undetectable		 3kp6A-1ha5A:
20.27
3kp6B-1ha5A:
20.27
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.
1inp INOSITOL
POLYPHOSPHATE
1-PHOSPHATASE

(Bos taurus) 		PF00459
(Inositol_P) 		5 LEU A  96
LEU A  56
ILE A  92
VAL A 110
LEU A 107
 None
 1.25A 3kp6A-1inpA:
undetectable
3kp6B-1inpA:
undetectable		 3kp6A-1inpA:
19.28
3kp6B-1inpA:
19.28
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.
1iuq GLYCEROL-3-PHOSPHATE
ACYLTRANSFERASE

(Cucurbita
moschata) 		PF01553
(Acyltransferase)
PF14829
(GPAT_N) 		5 LEU A  69
VAL A  34
LEU A  30
VAL A  76
LEU A  73
 None
 1.24A 3kp6A-1iuqA:
undetectable
3kp6B-1iuqA:
undetectable		 3kp6A-1iuqA:
17.65
3kp6B-1iuqA:
17.65
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.
1j2b ARCHAEOSINE
TRNA-GUANINE
TRANSGLYCOSYLASE

(Pyrococcus
horikoshii) 		PF01472
(PUA)
PF01702
(TGT)
PF14809
(TGT_C1)
PF14810
(TGT_C2) 		5 LEU A 491
VAL A 440
VAL A 472
ARG A 478
LEU A 479
 None
None
None
G  C 969 ( 3.1A)
None
 1.14A 3kp6A-1j2bA:
undetectable
3kp6B-1j2bA:
undetectable		 3kp6A-1j2bA:
14.75
3kp6B-1j2bA:
14.75
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.
1j8m SIGNAL RECOGNITION
54 KDA PROTEIN

(Acidianus
ambivalens) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 HIS F 294
LEU F 293
ILE F  73
VAL F  76
LEU F  80
 None
 1.00A 3kp6A-1j8mF:
undetectable
3kp6B-1j8mF:
undetectable		 3kp6A-1j8mF:
19.87
3kp6B-1j8mF:
19.87
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.
1jeq KU70

(Homo sapiens) 		PF02037
(SAP)
PF02735
(Ku)
PF03730
(Ku_C)
PF03731
(Ku_N) 		5 VAL A 271
LEU A 261
ILE A 273
VAL A 368
LEU A 413
 None
 1.28A 3kp6A-1jeqA:
undetectable
3kp6B-1jeqA:
undetectable		 3kp6A-1jeqA:
13.80
3kp6B-1jeqA:
13.80
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.
1jke D-TYR-TRNATYR
DEACYLASE

(Escherichia
coli) 		PF02580
(Tyr_Deacylase) 		5 VAL A  29
LEU A  31
VAL A  49
ARG A  48
LEU A  45
 None
 1.29A 3kp6A-1jkeA:
undetectable
3kp6B-1jkeA:
undetectable		 3kp6A-1jkeA:
21.08
3kp6B-1jkeA:
21.08
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.
1kh2 ARGININOSUCCINATE
SYNTHETASE

(Thermus
thermophilus) 		PF00764
(Arginosuc_synth) 		5 LEU A 278
VAL A 228
ILE A 245
VAL A 216
LEU A 339
 None
 1.39A 3kp6A-1kh2A:
undetectable
3kp6B-1kh2A:
undetectable		 3kp6A-1kh2A:
17.75
3kp6B-1kh2A:
17.75
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.
1l1q ADENINE
PHOSPHORIBOSYLTRANSF
ERASE

(Giardia
intestinalis) 		PF00156
(Pribosyltran) 		5 LEU A  38
VAL A 177
LEU A 155
VAL A  45
ARG A  42
 None
 1.40A 3kp6A-1l1qA:
undetectable
3kp6B-1l1qA:
undetectable		 3kp6A-1l1qA:
25.38
3kp6B-1l1qA:
25.38
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.
1l2u OROTIDINE
5'-PHOSPHATE
DECARBOXYLASE

(Escherichia
coli) 		PF00215
(OMPdecase) 		5 LEU A  30
VAL A  58
LEU A  61
VAL A  45
LEU A  21
 None
 1.41A 3kp6A-1l2uA:
undetectable
3kp6B-1l2uA:
undetectable		 3kp6A-1l2uA:
22.63
3kp6B-1l2uA:
22.63
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.
1m1c MAJOR COAT PROTEIN

(Saccharomyces
cerevisiae
virus L-A) 		PF09220
(LA-virus_coat) 		5 LEU A 123
VAL A 211
LEU A 215
VAL A 203
LEU A 201
 None
 1.40A 3kp6A-1m1cA:
0.3
3kp6B-1m1cA:
undetectable		 3kp6A-1m1cA:
14.40
3kp6B-1m1cA:
14.40
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.
1mec MENGO VIRUS COAT
PROTEIN (SUBUNIT
VP1)

(Cardiovirus A) 		no annotation 5 VAL 1  69
LEU 1 225
ILE 1  43
VAL 1 238
LEU 1 131
 None
 1.17A 3kp6A-1mec1:
undetectable
3kp6B-1mec1:
undetectable		 3kp6A-1mec1:
18.61
3kp6B-1mec1:
18.61
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.
1nkq HYPOTHETICAL 28.8
KDA PROTEIN IN
PSD1-SKO1 INTERGENIC
REGION

(Saccharomyces
cerevisiae) 		PF01557
(FAA_hydrolase) 		5 LEU A  90
VAL A 154
ILE A 240
VAL A 241
LEU A 118
 None
 1.42A 3kp6A-1nkqA:
undetectable
3kp6B-1nkqA:
undetectable		 3kp6A-1nkqA:
21.32
3kp6B-1nkqA:
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.
1nsa PROCARBOXYPEPTIDASE
B

(Sus scrofa) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		5 HIS A  27
LEU A  29
VAL A  52
ILE A  46
VAL A  17
 None
 1.06A 3kp6A-1nsaA:
0.5
3kp6B-1nsaA:
1.0		 3kp6A-1nsaA:
18.00
3kp6B-1nsaA:
18.00
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.
1nsa PROCARBOXYPEPTIDASE
B

(Sus scrofa) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		5 LEU A  29
VAL A  52
ILE A  46
VAL A  17
LEU A  73
 None
 1.34A 3kp6A-1nsaA:
0.5
3kp6B-1nsaA:
1.0		 3kp6A-1nsaA:
18.00
3kp6B-1nsaA:
18.00
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.
1ny5 TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00072
(Response_reg)
PF00158
(Sigma54_activat) 		5 LEU A 183
LEU A 150
ILE A 305
VAL A 176
LEU A 179
 None
 1.40A 3kp6A-1ny5A:
undetectable
3kp6B-1ny5A:
undetectable		 3kp6A-1ny5A:
20.67
3kp6B-1ny5A:
20.67
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.
1ocm MALONAMIDASE E2

(Bradyrhizobium
japonicum) 		PF01425
(Amidase) 		5 LEU A 146
VAL A 190
ILE A  65
VAL A  90
LEU A  94
 None
 1.39A 3kp6A-1ocmA:
undetectable
3kp6B-1ocmA:
undetectable		 3kp6A-1ocmA:
15.00
3kp6B-1ocmA:
15.00
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.
1oki BETA CRYSTALLIN B1

(Homo sapiens) 		PF00030
(Crystall) 		5 LEU A 115
VAL A  90
LEU A 135
VAL A  62
LEU A  60
 None
 1.41A 3kp6A-1okiA:
undetectable
3kp6B-1okiA:
undetectable		 3kp6A-1okiA:
20.85
3kp6B-1okiA:
20.85
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.
1p2x RAS
GTPASE-ACTIVATING-LI
KE PROTEIN

(Schizosaccharomyces
pombe) 		PF00307
(CH) 		5 HIS A 141
LEU A 143
LEU A  75
ILE A 137
VAL A 136
 None
 1.42A 3kp6A-1p2xA:
undetectable
3kp6B-1p2xA:
undetectable		 3kp6A-1p2xA:
23.26
3kp6B-1p2xA:
23.26
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.
1p5s RAS
GTPASE-ACTIVATING-LI
KE PROTEIN RNG2

(Schizosaccharomyces
pombe) 		PF00307
(CH) 		5 HIS A 141
LEU A 143
LEU A  75
ILE A 137
VAL A 136
 None
HG  A 191 ( 4.8A)
None
None
None
 1.43A 3kp6A-1p5sA:
undetectable
3kp6B-1p5sA:
undetectable		 3kp6A-1p5sA:
24.88
3kp6B-1p5sA:
24.88
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.
1pgw BEAN POD MOTTLE
VIRUS SMALL (S)
SUBUNIT

(Bean pod mottle
virus) 		PF02248
(Como_SCP) 		5 LEU 1  60
VAL 1  32
LEU 1  34
VAL 1 162
LEU 1 164
 None
 1.33A 3kp6A-1pgw1:
undetectable
3kp6B-1pgw1:
undetectable		 3kp6A-1pgw1:
23.16
3kp6B-1pgw1:
23.16
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.
1pxy FIMBRIN-LIKE PROTEIN

(Arabidopsis
thaliana) 		PF00307
(CH) 		5 LEU A 466
LEU A 493
ILE A 460
VAL A 459
LEU A 428
 None
 1.36A 3kp6A-1pxyA:
undetectable
3kp6B-1pxyA:
undetectable		 3kp6A-1pxyA:
16.44
3kp6B-1pxyA:
16.44
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.
1q50 GLUCOSE-6-PHOSPHATE
ISOMERASE

(Leishmania
mexicana) 		PF00342
(PGI) 		5 HIS A 147
VAL A 169
LEU A 173
ARG A 151
LEU A 349
 None
 1.25A 3kp6A-1q50A:
undetectable
3kp6B-1q50A:
undetectable		 3kp6A-1q50A:
13.87
3kp6B-1q50A:
13.87
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.
1q6w MONOAMINE OXIDASE
REGULATORY PROTEIN,
PUTATIVE

(Archaeoglobus
fulgidus) 		PF01575
(MaoC_dehydratas) 		5 VAL A  71
LEU A  72
ILE A 113
VAL A 138
LEU A 136
 None
 1.24A 3kp6A-1q6wA:
undetectable
3kp6B-1q6wA:
undetectable		 3kp6A-1q6wA:
21.59
3kp6B-1q6wA:
21.59
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.
1re5 3-CARBOXY-CIS,CIS-MU
CONATE
CYCLOISOMERASE

(Pseudomonas
putida) 		PF00206
(Lyase_1)
PF10397
(ADSL_C) 		5 LEU A 132
VAL A 243
LEU A 247
ILE A 125
VAL A 334
 None
 1.31A 3kp6A-1re5A:
undetectable
3kp6B-1re5A:
0.6		 3kp6A-1re5A:
14.57
3kp6B-1re5A:
14.57
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.
1rp3 RNA POLYMERASE SIGMA
FACTOR SIGMA-28
(FLIA)

(Aquifex
aeolicus) 		PF04539
(Sigma70_r3)
PF04542
(Sigma70_r2)
PF04545
(Sigma70_r4) 		5 VAL A 206
LEU A 210
ILE A 196
VAL A 192
LEU A 191
 None
 1.42A 3kp6A-1rp3A:
2.2
3kp6B-1rp3A:
4.6		 3kp6A-1rp3A:
22.69
3kp6B-1rp3A:
22.69
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.
1rpx PROTEIN
(RIBULOSE-PHOSPHATE
3-EPIMERASE)

(Solanum
tuberosum) 		PF00834
(Ribul_P_3_epim) 		5 HIS A 108
VAL A 123
ILE A 111
VAL A 141
LEU A 138
 None
 1.09A 3kp6A-1rpxA:
undetectable
3kp6B-1rpxA:
undetectable		 3kp6A-1rpxA:
21.07
3kp6B-1rpxA:
21.07
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.
1ry9 SURFACE PRESENTATION
OF ANTIGENS PROTEIN
SPAK

(Shigella
flexneri) 		PF03519
(Invas_SpaK) 		5 LEU A 119
VAL A 109
LEU A   9
ILE A 104
VAL A  52
 CL  A 303 ( 4.7A)
CL  A 301 (-4.7A)
None
None
None
 1.38A 3kp6A-1ry9A:
undetectable
3kp6B-1ry9A:
undetectable		 3kp6A-1ry9A:
22.89
3kp6B-1ry9A:
22.89
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.
1s7g NAD-DEPENDENT
DEACETYLASE 2

(Archaeoglobus
fulgidus) 		PF02146
(SIR2) 		5 LEU A  12
VAL A 238
LEU A 239
ILE A 231
VAL A 216
 None
 1.15A 3kp6A-1s7gA:
undetectable
3kp6B-1s7gA:
undetectable		 3kp6A-1s7gA:
19.07
3kp6B-1s7gA:
19.07
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.
1sbz PROBABLE AROMATIC
ACID DECARBOXYLASE

(Escherichia
coli) 		PF02441
(Flavoprotein) 		5 LEU A   3
VAL A 169
LEU A 170
ILE A  84
LEU A  23
 None
 1.22A 3kp6A-1sbzA:
undetectable
3kp6B-1sbzA:
undetectable		 3kp6A-1sbzA:
21.39
3kp6B-1sbzA:
21.39
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.
1sma MALTOGENIC AMYLASE

(Thermus sp.
IM6501) 		PF00128
(Alpha-amylase)
PF02903
(Alpha-amylase_N)
PF16657
(Malt_amylase_C) 		5 VAL A 229
LEU A 228
ILE A 322
VAL A 239
LEU A 195
 None
 1.15A 3kp6A-1smaA:
undetectable
3kp6B-1smaA:
undetectable		 3kp6A-1smaA:
13.40
3kp6B-1smaA:
13.40
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.
1szq 2-METHYLCITRATE
DEHYDRATASE

(Escherichia
coli) 		PF03972
(MmgE_PrpD) 		5 VAL A 352
LEU A 356
ILE A 322
VAL A 320
LEU A 409
 None
 1.08A 3kp6A-1szqA:
0.0
3kp6B-1szqA:
undetectable		 3kp6A-1szqA:
14.12
3kp6B-1szqA:
14.12
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.
1t8t HEPARAN SULFATE
D-GLUCOSAMINYL
3-O-SULFOTRANSFERASE
3A1

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		5 VAL A 326
LEU A 323
ILE A 239
VAL A 310
LEU A 315
 None
 1.04A 3kp6A-1t8tA:
undetectable
3kp6B-1t8tA:
undetectable		 3kp6A-1t8tA:
20.15
3kp6B-1t8tA:
20.15
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.
1ta3 ENDO-1,4-BETA-XYLANA
SE

(Aspergillus
nidulans) 		PF00331
(Glyco_hydro_10) 		5 VAL B  67
LEU B  66
ILE B 120
VAL B  77
ARG B  78
 None
 1.14A 3kp6A-1ta3B:
undetectable
3kp6B-1ta3B:
undetectable		 3kp6A-1ta3B:
17.32
3kp6B-1ta3B:
17.32
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.
1th8 ANTI-SIGMA F FACTOR
ANTAGONIST

(Geobacillus
stearothermophilus) 		PF01740
(STAS) 		5 VAL B  34
LEU B  30
ILE B  46
VAL B  16
LEU B  18
 None
 1.05A 3kp6A-1th8B:
undetectable
3kp6B-1th8B:
undetectable		 3kp6A-1th8B:
25.66
3kp6B-1th8B:
25.66
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.
1tlq HYPOTHETICAL PROTEIN
YPJQ

(Bacillus
subtilis) 		PF04608
(PgpA) 		5 VAL A 147
LEU A 150
VAL A  24
ARG A  22
LEU A  19
 None
 1.30A 3kp6A-1tlqA:
0.2
3kp6B-1tlqA:
undetectable		 3kp6A-1tlqA:
20.62
3kp6B-1tlqA:
20.62
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.
1tzq EQUINATOXIN II

(Actinia equina) 		PF06369
(Anemone_cytotox) 		5 VAL A 102
LEU A  90
ILE A 174
VAL A  37
LEU A  71
 None
 1.34A 3kp6A-1tzqA:
undetectable
3kp6B-1tzqA:
undetectable		 3kp6A-1tzqA:
21.16
3kp6B-1tzqA:
21.16
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.
1u3b AMYLOID BETA A4
PRECURSOR
PROTEIN-BINDING,
FAMILY A, MEMBER 1

(Homo sapiens) 		PF00595
(PDZ) 		5 LEU A  93
VAL A  33
LEU A  31
ILE A  35
LEU A 101
 None
 1.25A 3kp6A-1u3bA:
undetectable
3kp6B-1u3bA:
undetectable		 3kp6A-1u3bA:
23.81
3kp6B-1u3bA:
23.81
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.
1u6g TIP120 PROTEIN

(Homo sapiens) 		PF08623
(TIP120) 		5 LEU C  54
VAL C  69
LEU C  72
ILE C 105
LEU C  91
 None
 1.07A 3kp6A-1u6gC:
undetectable
3kp6B-1u6gC:
undetectable		 3kp6A-1u6gC:
9.65
3kp6B-1u6gC:
9.65
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.
1u6g TIP120 PROTEIN

(Homo sapiens) 		PF08623
(TIP120) 		5 LEU C 102
VAL C  69
LEU C  57
ILE C 108
LEU C  91
 None
 1.38A 3kp6A-1u6gC:
undetectable
3kp6B-1u6gC:
undetectable		 3kp6A-1u6gC:
9.65
3kp6B-1u6gC:
9.65
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.
1uf2 CORE PROTEIN P3

(Rice dwarf
virus) 		PF09231
(RDV-p3) 		5 VAL A 141
LEU A  65
ILE A 985
VAL A 983
LEU A 229
 None
 1.25A 3kp6A-1uf2A:
0.7
3kp6B-1uf2A:
undetectable		 3kp6A-1uf2A:
10.11
3kp6B-1uf2A:
10.11
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.
1ulq PUTATIVE ACETYL-COA
ACETYLTRANSFERASE

(Thermus
thermophilus) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 LEU A  93
VAL A 370
LEU A 369
ILE A   6
VAL A 397
 None
 1.28A 3kp6A-1ulqA:
undetectable
3kp6B-1ulqA:
undetectable		 3kp6A-1ulqA:
18.03
3kp6B-1ulqA:
18.03
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.
1ve2 UROPORPHYRIN-III
C-METHYLTRANSFERASE

(Thermus
thermophilus) 		PF00590
(TP_methylase) 		5 VAL A  25
LEU A  26
VAL A   8
ARG A  83
LEU A  84
 None
 1.40A 3kp6A-1ve2A:
undetectable
3kp6B-1ve2A:
undetectable		 3kp6A-1ve2A:
20.17
3kp6B-1ve2A:
20.17
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.
1w5t ORC2

(Aeropyrum
pernix) 		PF09079
(Cdc6_C)
PF13401
(AAA_22) 		5 LEU A  48
VAL A 167
VAL A 130
ARG A 179
LEU A 133
 None
 1.34A 3kp6A-1w5tA:
4.7
3kp6B-1w5tA:
6.4		 3kp6A-1w5tA:
20.10
3kp6B-1w5tA:
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.
1wfx PROBABLE RNA
2'-PHOSPHOTRANSFERAS
E

(Aeropyrum
pernix) 		PF01885
(PTS_2-RNA) 		5 LEU A  94
VAL A 119
ILE A 111
VAL A 169
LEU A 149
 None
 1.34A 3kp6A-1wfxA:
3.2
3kp6B-1wfxA:
4.4		 3kp6A-1wfxA:
20.69
3kp6B-1wfxA:
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.
1wkr POLYPOROPEPSIN

(Irpex lacteus) 		PF00026
(Asp) 		5 LEU A 143
VAL A   5
LEU A  79
VAL A  16
LEU A 105
 None
 1.41A 3kp6A-1wkrA:
undetectable
3kp6B-1wkrA:
undetectable		 3kp6A-1wkrA:
18.88
3kp6B-1wkrA:
18.88
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.
1wwk PHOSPHOGLYCERATE
DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 LEU A  64
VAL A 298
LEU A 302
ILE A  46
VAL A   3
 None
 1.42A 3kp6A-1wwkA:
undetectable
3kp6B-1wwkA:
undetectable		 3kp6A-1wwkA:
18.61
3kp6B-1wwkA:
18.61
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.
1x25 HYPOTHETICAL UPF0076
PROTEIN ST0811

(Sulfurisphaera
tokodaii) 		PF01042
(Ribonuc_L-PSP) 		5 LEU A  54
VAL A  28
ILE A  60
VAL A  61
LEU A  68
 None
 1.38A 3kp6A-1x25A:
undetectable
3kp6B-1x25A:
undetectable		 3kp6A-1x25A:
22.42
3kp6B-1x25A:
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.
1x7h PUTATIVE KETOACYL
REDUCTASE

(Streptomyces
coelicolor) 		PF00106
(adh_short) 		5 LEU A  31
VAL A  88
ILE A  22
VAL A 236
ARG A  25
 None
 1.41A 3kp6A-1x7hA:
undetectable
3kp6B-1x7hA:
undetectable		 3kp6A-1x7hA:
21.79
3kp6B-1x7hA:
21.79
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.
1xb7 STEROID HORMONE
RECEPTOR ERR1

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 HIS A 452
LEU A 451
VAL A 290
LEU A 293
LEU A 424
 None
 1.15A 3kp6A-1xb7A:
1.3
3kp6B-1xb7A:
undetectable		 3kp6A-1xb7A:
19.67
3kp6B-1xb7A:
19.67
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.
1xhb POLYPEPTIDE
N-ACETYLGALACTOSAMIN
YLTRANSFERASE 1

(Mus musculus) 		PF00535
(Glycos_transf_2)
PF00652
(Ricin_B_lectin) 		5 LEU A 222
VAL A 120
LEU A 208
ILE A 148
VAL A 139
 None
 1.13A 3kp6A-1xhbA:
undetectable
3kp6B-1xhbA:
undetectable		 3kp6A-1xhbA:
16.46
3kp6B-1xhbA:
16.46
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.
1xm9 PLAKOPHILIN 1

(Homo sapiens) 		PF00514
(Arm) 		5 VAL A 619
LEU A 623
VAL A 644
ARG A 645
LEU A 686
 None
 1.32A 3kp6A-1xm9A:
undetectable
3kp6B-1xm9A:
undetectable		 3kp6A-1xm9A:
15.50
3kp6B-1xm9A:
15.50
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.
1xn4 RIBONUCLEASE MAR1

(Leishmania
major) 		PF00857
(Isochorismatase) 		5 VAL A 117
LEU A 120
ILE A 113
VAL A 104
LEU A  16
 None
 1.15A 3kp6A-1xn4A:
undetectable
3kp6B-1xn4A:
undetectable		 3kp6A-1xn4A:
25.49
3kp6B-1xn4A:
25.49
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.
1y8q UBIQUITIN-LIKE 2
ACTIVATING ENZYME
E1B

(Homo sapiens) 		PF00899
(ThiF)
PF14732
(UAE_UbL)
PF16195
(UBA2_C) 		5 LEU B 506
VAL B 469
ILE B 491
VAL B 480
LEU B 517
 None
 1.23A 3kp6A-1y8qB:
undetectable
3kp6B-1y8qB:
undetectable		 3kp6A-1y8qB:
14.01
3kp6B-1y8qB:
14.01
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.
1yq2 BETA-GALACTOSIDASE

(Arthrobacter
sp. C2-2) 		PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		5 LEU A  35
VAL A 173
LEU A 141
VAL A 154
LEU A 184
 None
 1.37A 3kp6A-1yq2A:
undetectable
3kp6B-1yq2A:
undetectable		 3kp6A-1yq2A:
8.91
3kp6B-1yq2A:
8.91
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.
1zz3 HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE

(Alcaligenaceae
bacterium FB188) 		PF00850
(Hist_deacetyl) 		5 LEU A 177
VAL A 248
ILE A 228
VAL A 230
LEU A 202
 None
 1.01A 3kp6A-1zz3A:
undetectable
3kp6B-1zz3A:
undetectable		 3kp6A-1zz3A:
18.44
3kp6B-1zz3A:
18.44
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.
2ass S-PHASE
KINASE-ASSOCIATED
PROTEIN 2

(Homo sapiens) 		PF12937
(F-box-like) 		5 LEU B2235
LEU B2263
ILE B2285
VAL B2281
LEU B2252
 None
 0.92A 3kp6A-2assB:
undetectable
3kp6B-2assB:
undetectable		 3kp6A-2assB:
16.67
3kp6B-2assB:
16.67
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.
2ast CYCLIN-DEPENDENT
KINASES REGULATORY
SUBUNIT 1

(Homo sapiens) 		PF01111
(CKS) 		5 VAL C3022
LEU C3067
ILE C3006
VAL C3048
LEU C3046
 None
 1.24A 3kp6A-2astC:
undetectable
3kp6B-2astC:
undetectable		 3kp6A-2astC:
16.56
3kp6B-2astC:
16.56
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.
2auj DNA-DIRECTED RNA
POLYMERASE BETA'
CHAIN

(Thermus
aquaticus) 		no annotation 5 HIS D 332
LEU D 223
LEU D 242
VAL D 322
LEU D 335
 None
 1.29A 3kp6A-2aujD:
undetectable
3kp6B-2aujD:
undetectable		 3kp6A-2aujD:
17.68
3kp6B-2aujD:
17.68
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.
2bej SEGREGATION PROTEIN

(Thermus
thermophilus) 		PF13614
(AAA_31) 		5 VAL A 242
LEU A 238
ILE A   9
VAL A 138
LEU A 175
 None
 1.40A 3kp6A-2bejA:
undetectable
3kp6B-2bejA:
undetectable		 3kp6A-2bejA:
21.71
3kp6B-2bejA:
21.71
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.
2c3d 2-OXOPROPYL-COM
REDUCTASE

(Xanthobacter
autotrophicus) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 VAL A 397
LEU A 391
VAL A 261
ARG A 258
LEU A 249
 None
 1.24A 3kp6A-2c3dA:
undetectable
3kp6B-2c3dA:
undetectable		 3kp6A-2c3dA:
15.27
3kp6B-2c3dA:
15.27
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.
2chr CHLOROMUCONATE
CYCLOISOMERASE

(Cupriavidus
necator) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 LEU A 175
VAL A 216
ILE A 219
VAL A 193
LEU A 166
 None
 1.25A 3kp6A-2chrA:
undetectable
3kp6B-2chrA:
undetectable		 3kp6A-2chrA:
18.63
3kp6B-2chrA:
18.63
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.
2cjw GTP-BINDING PROTEIN
GEM

(Homo sapiens) 		PF00071
(Ras) 		5 LEU A  91
LEU A 231
ILE A 127
VAL A  78
LEU A 154
 None
 1.43A 3kp6A-2cjwA:
undetectable
3kp6B-2cjwA:
undetectable		 3kp6A-2cjwA:
24.27
3kp6B-2cjwA:
24.27
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.
2cq2 HYPOTHETICAL PROTEIN
LOC91801

(Homo sapiens) 		PF00076
(RRM_1) 		5 LEU A 117
VAL A  64
LEU A  61
VAL A 105
LEU A 115
 None
 1.33A 3kp6A-2cq2A:
undetectable
3kp6B-2cq2A:
undetectable		 3kp6A-2cq2A:
21.79
3kp6B-2cq2A:
21.79
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.
2cu1 MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE 2

(Homo sapiens) 		PF00564
(PB1) 		5 LEU A  58
VAL A  68
LEU A  80
VAL A  28
LEU A  33
 None
 1.12A 3kp6A-2cu1A:
undetectable
3kp6B-2cu1A:
undetectable		 3kp6A-2cu1A:
24.07
3kp6B-2cu1A:
24.07
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.
2cun PHOSPHOGLYCERATE
KINASE

(Pyrococcus
horikoshii) 		PF00162
(PGK) 		5 VAL A  75
LEU A  76
ILE A  29
ARG A  34
LEU A  20
 None
None
None
3PG  A 503 (-2.9A)
None
 1.39A 3kp6A-2cunA:
undetectable
3kp6B-2cunA:
undetectable		 3kp6A-2cunA:
19.37
3kp6B-2cunA:
19.37
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.
2cwa SINGLE-STRAND
BINDING PROTEIN

(Thermus
thermophilus) 		PF00436
(SSB) 		5 LEU A 188
VAL A 196
LEU A 223
VAL A 175
LEU A 155
 None
 1.32A 3kp6A-2cwaA:
undetectable
3kp6B-2cwaA:
undetectable		 3kp6A-2cwaA:
17.87
3kp6B-2cwaA:
17.87
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.
2cwd LOW MOLECULAR WEIGHT
PHOSPHOTYROSINE
PROTEIN PHOSPHATASE

(Thermus
thermophilus) 		PF01451
(LMWPc) 		5 VAL A  98
LEU A  99
ILE A  87
VAL A  89
ARG A 110
 None
 1.35A 3kp6A-2cwdA:
undetectable
3kp6B-2cwdA:
undetectable		 3kp6A-2cwdA:
21.43
3kp6B-2cwdA:
21.43
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.
2cxn GLUCOSE-6-PHOSPHATE
ISOMERASE

(Mus musculus) 		PF00342
(PGI) 		5 HIS A 100
VAL A 122
LEU A 126
ARG A 104
LEU A 297
 None
 1.22A 3kp6A-2cxnA:
undetectable
3kp6B-2cxnA:
undetectable		 3kp6A-2cxnA:
13.42
3kp6B-2cxnA:
13.42
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.
2d1v TRANSCRIPTIONAL
REGULATORY PROTEIN
YYCF

(Bacillus
subtilis) 		PF00486
(Trans_reg_C) 		5 HIS A 167
LEU A 205
ILE A 142
VAL A 149
LEU A 158
 None
 1.35A 3kp6A-2d1vA:
3.4
3kp6B-2d1vA:
4.7		 3kp6A-2d1vA:
20.53
3kp6B-2d1vA:
20.53
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.
2d3y URACIL-DNA
GLYCOSYLASE

(Thermus
thermophilus) 		PF03167
(UDG) 		5 LEU A  81
VAL A 148
LEU A  55
VAL A 209
LEU A 210
 None
 1.40A 3kp6A-2d3yA:
undetectable
3kp6B-2d3yA:
undetectable		 3kp6A-2d3yA:
19.48
3kp6B-2d3yA:
19.48
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.
2dkj SERINE
HYDROXYMETHYLTRANSFE
RASE

(Thermus
thermophilus) 		PF00464
(SHMT) 		5 VAL A 101
LEU A 105
ILE A 236
VAL A 219
LEU A 243
 None
 1.14A 3kp6A-2dkjA:
undetectable
3kp6B-2dkjA:
undetectable		 3kp6A-2dkjA:
16.38
3kp6B-2dkjA:
16.38
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.
2ell ACIDIC LEUCINE-RICH
NUCLEAR
PHOSPHOPROTEIN 32
FAMILY MEMBER B

(Homo sapiens) 		PF14580
(LRR_9) 		5 LEU A  56
VAL A  64
LEU A  67
ILE A  83
LEU A  76
 None
 0.85A 3kp6A-2ellA:
undetectable
3kp6B-2ellA:
undetectable		 3kp6A-2ellA:
26.19
3kp6B-2ellA:
26.19
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.
2fk9 PROTEIN KINASE C,
ETA TYPE

(Homo sapiens) 		PF00168
(C2) 		5 LEU A 108
VAL A  76
LEU A  12
VAL A  49
LEU A  82
 None
 1.28A 3kp6A-2fk9A:
undetectable
3kp6B-2fk9A:
undetectable		 3kp6A-2fk9A:
22.73
3kp6B-2fk9A:
22.73
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.
2fvz INOSITOL
MONOPHOSPHATASE 2

(Homo sapiens) 		PF00459
(Inositol_P) 		5 LEU A 128
LEU A 232
ILE A 239
VAL A 246
LEU A 254
 None
 1.24A 3kp6A-2fvzA:
undetectable
3kp6B-2fvzA:
undetectable		 3kp6A-2fvzA:
22.11
3kp6B-2fvzA:
22.11
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.
2g3y GTP-BINDING PROTEIN
GEM

(Homo sapiens) 		PF00071
(Ras) 		5 LEU A  91
LEU A 231
ILE A 127
VAL A  78
LEU A 154
 None
 1.38A 3kp6A-2g3yA:
undetectable
3kp6B-2g3yA:
undetectable		 3kp6A-2g3yA:
21.43
3kp6B-2g3yA:
21.43
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.
2icy PROBABLE
UTP-GLUCOSE-1-PHOSPH
ATE
URIDYLYLTRANSFERASE
2

(Arabidopsis
thaliana) 		PF01704
(UDPGP) 		5 LEU A 301
VAL A 218
LEU A  83
VAL A 195
LEU A 199
 None
 1.14A 3kp6A-2icyA:
undetectable
3kp6B-2icyA:
undetectable		 3kp6A-2icyA:
18.04
3kp6B-2icyA:
18.04
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.
2ihf SINGLE-STRANDED
DNA-BINDING PROTEIN

(Thermus
aquaticus) 		PF00436
(SSB) 		5 LEU A 189
VAL A 197
LEU A 224
VAL A 176
LEU A 155
 None
 1.32A 3kp6A-2ihfA:
undetectable
3kp6B-2ihfA:
undetectable		 3kp6A-2ihfA:
21.40
3kp6B-2ihfA:
21.40
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.
2ihf SINGLE-STRANDED
DNA-BINDING PROTEIN

(Thermus
aquaticus) 		PF00436
(SSB) 		5 LEU A 201
VAL A 197
LEU A 133
VAL A 176
ARG A 218
 None
 1.26A 3kp6A-2ihfA:
undetectable
3kp6B-2ihfA:
undetectable		 3kp6A-2ihfA:
21.40
3kp6B-2ihfA:
21.40
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.
2ism PUTATIVE
OXIDOREDUCTASE

(Thermus
thermophilus) 		PF07995
(GSDH) 		5 VAL A 107
LEU A 124
ILE A 140
VAL A 150
LEU A 172
 None
 1.32A 3kp6A-2ismA:
undetectable
3kp6B-2ismA:
undetectable		 3kp6A-2ismA:
16.48
3kp6B-2ismA:
16.48