SIMILAR PATTERNS OF AMINO ACIDS FOR 4FFW_B_715B801

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.
1b6r PROTEIN
(N5-CARBOXYAMINOIMID
AZOLE RIBONUCLEOTIDE
SYNTHETASE)

(Escherichia
coli) 		PF02222
(ATP-grasp) 		5 ARG A 190
GLY A 187
SER A 288
VAL A 309
VAL A 315
 None
 1.34A 4ffwB-1b6rA:
undetectable		 4ffwB-1b6rA:
16.85
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.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLU A 152
GLY A 134
TYR A 251
TYR A 154
VAL A 164
 FAD  A 600 (-2.5A)
None
FAD  A 600 (-4.5A)
FAD  A 600 (-3.7A)
None
 1.45A 4ffwB-1bhyA:
undetectable		 4ffwB-1bhyA:
19.17
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.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLU A 152
GLY A 233
VAL A 164
TYR A 251
VAL A 160
 FAD  A 600 (-2.5A)
FAD  A 600 (-3.8A)
None
FAD  A 600 (-4.5A)
FAD  A 600 (-3.4A)
 1.49A 4ffwB-1bhyA:
undetectable		 4ffwB-1bhyA:
19.17
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.
1bhy P64K

(Neisseria
meningitidis) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLU A 152
VAL A 164
TYR A 251
TYR A 154
VAL A 160
 FAD  A 600 (-2.5A)
None
FAD  A 600 (-4.5A)
FAD  A 600 (-3.7A)
FAD  A 600 (-3.4A)
 1.28A 4ffwB-1bhyA:
undetectable		 4ffwB-1bhyA:
19.17
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.
1knr L-ASPARTATE OXIDASE

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		5 ARG A 290
GLU A 260
GLU A 121
GLY A 123
HIS A 351
 CL  A 541 ( 4.6A)
None
CL  A 541 ( 4.2A)
None
FAD  A 800 (-4.2A)
 1.37A 4ffwB-1knrA:
undetectable		 4ffwB-1knrA:
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.
1kol FORMALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 GLY A 195
SER A 285
VAL A 289
TYR A 190
HIS A 269
 NAD  A1403 (-3.4A)
None
None
None
SO4  A1003 ( 3.9A)
 1.29A 4ffwB-1kolA:
undetectable		 4ffwB-1kolA:
20.30
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.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE

(Lactococcus
lactis) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N) 		5 GLU A 396
SER A 348
TYR A 380
VAL A 471
HIS A 498
 None
 0.44A 4ffwB-1lnsA:
7.4		 4ffwB-1lnsA:
21.49
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.
1lns X-PROLYL DIPEPTIDYL
AMINOPEPTIDASE

(Lactococcus
lactis) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C)
PF09168
(PepX_N) 		5 TYR A 210
SER A 348
TYR A 380
VAL A 471
HIS A 498
 None
 0.66A 4ffwB-1lnsA:
7.4		 4ffwB-1lnsA:
21.49
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.
1nzy 4-CHLOROBENZOYL
COENZYME A
DEHALOGENASE

(Pseudomonas sp.
CBS3) 		PF00378
(ECH_1) 		5 GLU B  15
GLY B  55
VAL B  48
VAL B   9
HIS B   7
 None
 1.49A 4ffwB-1nzyB:
undetectable		 4ffwB-1nzyB:
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.
1t0b THUA-LIKE PROTEIN

(Geobacillus
stearothermophilus) 		PF06283
(ThuA) 		5 GLU A 152
GLU A 128
PHE A 179
VAL A 213
VAL A 210
 None
 1.08A 4ffwB-1t0bA:
undetectable		 4ffwB-1t0bA:
16.55
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
LARGE SUBUNIT

(Pseudomonas
putida) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 ARG B  49
GLU B 287
GLU B 283
VAL B 268
VAL B  45
 None
 1.31A 4ffwB-1t3qB:
undetectable		 4ffwB-1t3qB:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u8x MALTOSE-6'-PHOSPHATE
GLUCOSIDASE

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		5 GLY X  14
TYR X 120
SER X 124
VAL X 154
VAL X 128
 NAD  X 900 (-3.4A)
None
None
None
None
 1.27A 4ffwB-1u8xX:
undetectable		 4ffwB-1u8xX:
19.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1z68 FIBROBLAST
ACTIVATION PROTEIN,
ALPHA SUBUNIT

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		10 ARG A 123
GLU A 203
GLU A 204
TYR A 541
SER A 624
VAL A 650
TYR A 656
TYR A 660
VAL A 705
HIS A 734
 None
 0.58A 4ffwB-1z68A:
47.9		 4ffwB-1z68A:
54.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1z68 FIBROBLAST
ACTIVATION PROTEIN,
ALPHA SUBUNIT

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		7 ARG A 123
PHE A 350
TYR A 541
SER A 624
VAL A 650
TYR A 660
HIS A 734
 None
 1.11A 4ffwB-1z68A:
47.9		 4ffwB-1z68A:
54.76
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.
2b39 C3

(Bos taurus) 		PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF01835
(A2M_N)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
PF07703
(A2M_N_2)
PF10569
(Thiol-ester_cl) 		5 GLU A1127
GLY A1130
TYR A1391
SER A1479
TYR A1227
 None
 1.42A 4ffwB-2b39A:
undetectable		 4ffwB-2b39A:
18.21
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.
2bk8 TITIN HEART ISOFORM
N2-B

(Homo sapiens) 		PF07679
(I-set) 		5 ARG A  95
GLU A  88
VAL A  18
TYR A  20
TYR A  72
 None
 1.43A 4ffwB-2bk8A:
undetectable		 4ffwB-2bk8A:
9.26
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.
2bkl PROLYL ENDOPEPTIDASE

(Myxococcus
xanthus) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 GLY A 248
TYR A 453
SER A 533
TYR A 578
VAL A 619
 None
ZAH  A1533 (-4.5A)
ZAH  A1533 (-1.4A)
None
None
 1.16A 4ffwB-2bklA:
23.7		 4ffwB-2bklA:
22.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		11 ARG A 125
GLU A 205
GLU A 206
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
TYR A 666
VAL A 711
HIS A 740
 SO4  A1769 ( 3.1A)
008  A1767 (-3.9A)
008  A1767 (-2.5A)
008  A1767 (-3.5A)
SO4  A1769 ( 4.5A)
SO4  A1769 ( 3.0A)
None
008  A1767 (-4.4A)
008  A1767 (-3.8A)
None
SO4  A1769 ( 4.1A)
 0.57A 4ffwB-2bucA:
51.3		 4ffwB-2bucA:
81.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLU A 205
PHE A 357
TYR A 547
VAL A 656
TYR A 662
 008  A1767 (-3.9A)
008  A1767 (-3.5A)
SO4  A1769 ( 4.5A)
None
008  A1767 (-4.4A)
 1.30A 4ffwB-2bucA:
51.3		 4ffwB-2bucA:
81.92
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.
2d5l DIPEPTIDYL
AMINOPEPTIDASE IV,
PUTATIVE

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLU A 205
GLY A 207
TYR A 518
VAL A 629
TYR A 639
 None
 1.12A 4ffwB-2d5lA:
31.6		 4ffwB-2d5lA:
27.39
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.
2d5l DIPEPTIDYL
AMINOPEPTIDASE IV,
PUTATIVE

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLU A 205
TYR A 518
SER A 603
TYR A 639
VAL A 680
 None
 1.32A 4ffwB-2d5lA:
31.6		 4ffwB-2d5lA:
27.39
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.
2d5l DIPEPTIDYL
AMINOPEPTIDASE IV,
PUTATIVE

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLU A 205
TYR A 518
SER A 603
VAL A 629
TYR A 639
 None
 0.87A 4ffwB-2d5lA:
31.6		 4ffwB-2d5lA:
27.39
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.
2d5l DIPEPTIDYL
AMINOPEPTIDASE IV,
PUTATIVE

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLY A 207
TYR A 518
VAL A 629
TYR A 635
TYR A 639
 None
 1.01A 4ffwB-2d5lA:
31.6		 4ffwB-2d5lA:
27.39
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.
2d5l DIPEPTIDYL
AMINOPEPTIDASE IV,
PUTATIVE

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		7 TYR A 518
SER A 603
VAL A 629
TYR A 635
TYR A 639
VAL A 681
HIS A 710
 None
 0.37A 4ffwB-2d5lA:
31.6		 4ffwB-2d5lA:
27.39
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.
2ecf DIPEPTIDYL PEPTIDASE
IV

(Stenotrophomonas
maltophilia) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		8 GLU A 207
TYR A 524
SER A 610
VAL A 636
TYR A 642
TYR A 646
VAL A 688
HIS A 717
 None
 0.63A 4ffwB-2ecfA:
34.8		 4ffwB-2ecfA:
28.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		11 ARG A 125
GLU A 205
GLU A 206
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
TYR A 666
VAL A 711
HIS A 740
 ACF  A 800 (-3.4A)
ACF  A 800 (-3.6A)
ACF  A 800 (-3.2A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
ACF  A 800 (-3.3A)
None
None
 0.39A 4ffwB-2g5tA:
51.6		 4ffwB-2g5tA:
84.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		7 GLU A 205
PHE A 357
TYR A 547
SER A 630
VAL A 656
TYR A 662
VAL A 711
 ACF  A 800 (-3.6A)
None
ACF  A 800 (-4.5A)
ACF  A 800 (-1.3A)
None
ACF  A 800 (-4.1A)
None
 1.29A 4ffwB-2g5tA:
51.6		 4ffwB-2g5tA:
84.50
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.
2iuy GLYCOSYLTRANSFERASE

(Streptomyces
viridochromogenes) 		PF00534
(Glycos_transf_1) 		5 GLY A  38
SER A 269
VAL A 273
TYR A 162
VAL A 157
 MES  A1353 ( 3.7A)
None
None
None
None
 1.35A 4ffwB-2iuyA:
4.6		 4ffwB-2iuyA:
18.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oae DIPEPTIDYL PEPTIDASE
4

(Rattus
norvegicus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		12 ARG A 123
GLU A 203
GLU A 204
GLY A 207
PHE A 355
TYR A 548
SER A 631
VAL A 657
TYR A 663
TYR A 667
VAL A 712
HIS A 741
 SO4  A 801 ( 3.1A)
AIL  A 901 (-3.8A)
AIL  A 901 (-2.9A)
AIL  A 901 ( 4.1A)
AIL  A 901 (-3.7A)
SO4  A 801 (-4.3A)
AIL  A 901 ( 2.8A)
None
AIL  A 901 (-4.3A)
AIL  A 901 (-3.8A)
AIL  A 901 (-4.9A)
SO4  A 801 (-4.1A)
 0.48A 4ffwB-2oaeA:
52.2		 4ffwB-2oaeA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oae DIPEPTIDYL PEPTIDASE
4

(Rattus
norvegicus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		7 GLU A 203
GLY A 207
PHE A 355
TYR A 548
SER A 631
VAL A 657
VAL A 712
 AIL  A 901 (-3.8A)
AIL  A 901 ( 4.1A)
AIL  A 901 (-3.7A)
SO4  A 801 (-4.3A)
AIL  A 901 ( 2.8A)
None
AIL  A 901 (-4.9A)
 1.46A 4ffwB-2oaeA:
52.2		 4ffwB-2oaeA:
100.00
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.
2qri H-2 CLASS I
HISTOCOMPATIBILITY
ANTIGEN K-B ALPHA
CHAIN, BETA-2
MICROGLOBULIN,
OVALBUMIN-DERIVED
PEPTIDE

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		5 ARG A 155
GLU A 152
GLY A 151
SER A  99
TYR A 116
 None
 1.49A 4ffwB-2qriA:
undetectable		 4ffwB-2qriA:
19.39
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.
2yd3 RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF07679
(I-set) 		5 GLY A 203
TYR A 217
SER A  51
VAL A  53
VAL A  90
 None
None
None
NA  A1229 (-4.5A)
None
 1.19A 4ffwB-2yd3A:
undetectable		 4ffwB-2yd3A:
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.
2zie PUTATIVE
MODIFICATION
METHYLASE

(Thermus
thermophilus) 		PF01555
(N6_N4_Mtase) 		5 ARG A  85
GLU A  82
PHE A 128
VAL A 263
VAL A  32
 None
 1.45A 4ffwB-2zieA:
undetectable		 4ffwB-2zieA:
18.50
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.
3aal PROBABLE
ENDONUCLEASE 4

(Geobacillus
kaustophilus) 		PF01261
(AP_endonuc_2) 		5 GLY A 112
TYR A  34
VAL A  67
VAL A 212
HIS A 214
 None
None
None
None
FE  A 302 (-3.4A)
 1.38A 4ffwB-3aalA:
undetectable		 4ffwB-3aalA:
16.73
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.
3aq1 THERMOSOME SUBUNIT

(Methanococcoides
burtonii) 		PF00118
(Cpn60_TCP1) 		5 GLU B 341
GLY B 347
VAL B 279
TYR B 300
VAL B 339
 None
 1.24A 4ffwB-3aq1B:
undetectable		 4ffwB-3aq1B:
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.
3ddu PROLYL ENDOPEPTIDASE

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 GLY A 254
TYR A 473
SER A 554
TYR A 599
VAL A 644
 552  A 901 (-4.4A)
ACT  A 801 (-4.5A)
ACT  A 801 ( 2.6A)
None
None
 0.98A 4ffwB-3dduA:
10.6		 4ffwB-3dduA:
21.76
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.
3ddu PROLYL ENDOPEPTIDASE

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 TYR A 473
SER A 554
VAL A 580
VAL A 644
HIS A 680
 ACT  A 801 (-4.5A)
ACT  A 801 ( 2.6A)
None
None
ACT  A 801 (-3.8A)
 0.31A 4ffwB-3dduA:
10.6		 4ffwB-3dduA:
21.76
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.
3ekg MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Azotobacter
vinelandii) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLU A 340
GLY A 164
PHE A 175
SER A 326
VAL A 330
 TLA  A 501 (-2.8A)
None
None
None
None
 1.37A 4ffwB-3ekgA:
undetectable		 4ffwB-3ekgA:
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.
3imf SHORT CHAIN
DEHYDROGENASE

(Bacillus
anthracis) 		PF13561
(adh_short_C2) 		5 TYR A 142
SER A 153
VAL A 111
VAL A 107
HIS A 152
 None
 1.34A 4ffwB-3imfA:
4.5		 4ffwB-3imfA:
16.39
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.
3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN

(Shewanella
oneidensis) 		PF16113
(ECH_2) 		5 GLU A 109
GLY A 135
TYR A 163
VAL A 327
TYR A 110
 FMT  A 403 ( 3.9A)
None
None
None
None
 1.28A 4ffwB-3ju1A:
3.4		 4ffwB-3ju1A:
20.30
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.
3lqc DNA POLYMERASE BETA

(Rattus
norvegicus) 		PF14791
(DNA_pol_B_thumb)
PF14792
(DNA_pol_B_palm) 		5 ARG B 182
GLY B 179
PHE B 278
TYR B 327
VAL B 313
 None
 1.25A 4ffwB-3lqcB:
undetectable		 4ffwB-3lqcB:
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.
3muo PROLYL ENDOPEPTIDASE

(Aeromonas
caviae) 		PF00326
(Peptidase_S9)
PF02897
(Peptidase_S9_N) 		5 TYR A 458
SER A 538
VAL A 564
VAL A 625
HIS A 657
 ZPR  A 701 (-4.4A)
ZPR  A 701 (-1.2A)
None
ZPR  A 701 (-4.9A)
ZPR  A 702 (-4.0A)
 0.38A 4ffwB-3muoA:
23.3		 4ffwB-3muoA:
22.93
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.
3nzq BIOSYNTHETIC
ARGININE
DECARBOXYLASE

(Escherichia
coli) 		PF02784
(Orn_Arg_deC_N) 		5 GLU A 360
GLY A 146
TYR A 568
SER A 275
HIS A 272
 None
None
SO4  A 701 (-4.8A)
SO4  A 701 (-2.6A)
None
 1.46A 4ffwB-3nzqA:
2.9		 4ffwB-3nzqA:
20.26
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.
3pdi NITROGENASE MOFE
COFACTOR
BIOSYNTHESIS PROTEIN
NIFE

(Azotobacter
vinelandii) 		PF00148
(Oxidored_nitro) 		5 GLU A 203
GLU A 209
GLY A 230
VAL A 339
TYR A 275
 None
 1.45A 4ffwB-3pdiA:
3.2		 4ffwB-3pdiA:
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.
3pt1 UPF0364 PROTEIN
YMR027W

(Saccharomyces
cerevisiae) 		PF01937
(DUF89) 		5 ARG A  23
GLU A 110
GLY A  16
TYR A 114
VAL A 290
 F6P  A1001 (-3.2A)
F6P  A1001 (-2.7A)
None
None
None
 1.45A 4ffwB-3pt1A:
undetectable		 4ffwB-3pt1A:
20.45
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.
3pxh RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE F

(Mus musculus) 		PF07679
(I-set) 		5 GLY A 203
TYR A 217
SER A  51
VAL A  53
VAL A  90
 None
 1.26A 4ffwB-3pxhA:
undetectable		 4ffwB-3pxhA:
13.97
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.
3rm5 HYDROXYMETHYLPYRIMID
INE/PHOSPHOMETHYLPYR
IMIDINE KINASE THI20

(Saccharomyces
cerevisiae) 		PF03070
(TENA_THI-4)
PF08543
(Phos_pyr_kin) 		5 GLY A 439
TYR A 472
VAL A 410
TYR A 379
HIS A 417
 None
 1.30A 4ffwB-3rm5A:
undetectable		 4ffwB-3rm5A:
22.07
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.
3u24 PUTATIVE LIPOPROTEIN

(Shewanella
oneidensis) 		PF05960
(DUF885) 		5 GLY A 472
TYR A 547
VAL A 291
TYR A 485
TYR A 484
 None
 1.30A 4ffwB-3u24A:
undetectable		 4ffwB-3u24A:
21.73
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.
3wy7 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Mycolicibacterium
smegmatis) 		PF00155
(Aminotran_1_2) 		5 ARG A 354
GLY A 339
SER A 311
VAL A 207
TYR A  45
 None
 1.33A 4ffwB-3wy7A:
2.5		 4ffwB-3wy7A:
18.76
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.
4a7k ALDOS-2-ULOSE
DEHYDRATASE

(Phanerochaete
chrysosporium) 		no annotation 5 GLU A 683
GLU A 518
GLY A 685
PHE A 737
VAL A 490
 None
 1.43A 4ffwB-4a7kA:
6.2		 4ffwB-4a7kA:
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.
4ldq METHYLTHIORIBOSE-1-P
HOSPHATE ISOMERASE

(Homo sapiens) 		PF01008
(IF-2B) 		5 GLU A 219
GLY A 171
PHE A 214
TYR A  27
TYR A 218
 None
 1.32A 4ffwB-4ldqA:
undetectable		 4ffwB-4ldqA:
19.89
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.
4nfn TAU-TUBULIN KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 ARG A 119
GLU A 231
PHE A 126
SER A 158
TYR A 205
 SO4  A 403 (-4.6A)
SO4  A 403 ( 4.9A)
None
2KC  A 401 ( 3.1A)
None
 1.30A 4ffwB-4nfnA:
3.4		 4ffwB-4nfnA:
17.71
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.
4pbv PROTEIN-TYROSINE
PHOSPHATASE
CRYPALPHA1 ISOFORM

(Gallus gallus) 		PF07679
(I-set)
PF13927
(Ig_3) 		5 GLY C 202
TYR C 216
SER C  50
VAL C  52
VAL C  89
 None
 1.34A 4ffwB-4pbvC:
undetectable		 4ffwB-4pbvC:
18.21
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.
4pbx RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF00041
(fn3)
PF07679
(I-set) 		5 GLY A 203
TYR A 217
SER A  51
VAL A  53
VAL A  90
 None
 1.17A 4ffwB-4pbxA:
undetectable		 4ffwB-4pbxA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q1v PUTATIVE DIPEPTIDYL
AMINOPEPTIDASE IV

(Bacteroides
ovatus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		6 TYR A 518
SER A 603
VAL A 629
TYR A 635
TYR A 639
HIS A 710
 PEG  A 801 ( 4.0A)
None
None
None
None
None
 0.32A 4ffwB-4q1vA:
32.4		 4ffwB-4q1vA:
27.31
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.
4tvv TYROSINE PHOSPHATASE
II SUPERFAMILY
PROTEIN

(Legionella
pneumophila) 		PF14566
(PTPlike_phytase) 		5 TYR A 115
VAL A 188
TYR A 195
VAL A 105
HIS A 230
 None
 1.35A 4ffwB-4tvvA:
undetectable		 4ffwB-4tvvA:
18.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4wjl INACTIVE DIPEPTIDYL
PEPTIDASE 10

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		5 GLU A 233
GLU A 234
TYR A 683
VAL A 730
HIS A 759
 None
 0.63A 4ffwB-4wjlA:
40.3		 4ffwB-4wjlA:
38.34
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.
4x00 PUTATIVE HYDROLASE

(Burkholderia
cenocepacia) 		PF12697
(Abhydrolase_6) 		5 GLY A 168
SER A 112
VAL A 139
VAL A 233
HIS A 259
 None
GOL  A 308 (-3.5A)
None
None
GOL  A 308 ( 4.5A)
 0.84A 4ffwB-4x00A:
6.1		 4ffwB-4x00A:
15.92
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.
4y25 POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
EXPORT PROTEIN

(Escherichia
coli) 		no annotation 5 ARG A 609
GLU A 592
GLU A 583
GLY A 612
TYR A 547
 None
 1.34A 4ffwB-4y25A:
undetectable		 4ffwB-4y25A:
18.58
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.
4y7d ALPHA/BETA HYDROLASE
FOLD PROTEIN

(Nakamurella
multipartita) 		PF00561
(Abhydrolase_1) 		5 SER A 104
VAL A 130
TYR A 134
VAL A 250
HIS A 275
 None
 0.73A 4ffwB-4y7dA:
6.2		 4ffwB-4y7dA:
17.49
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.
4ysh GLYCINE OXIDASE

(Geobacillus
kaustophilus) 		PF01266
(DAO) 		5 GLY A  48
PHE A 247
SER A 268
TYR A 335
VAL A 228
 FAD  A 401 (-4.1A)
None
SO4  A 402 (-3.8A)
None
None
 1.50A 4ffwB-4yshA:
undetectable		 4ffwB-4yshA:
19.59
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.
5dxf TREHALOSE-6-PHOSPHAT
E PHOSPHATASE

(Candida
albicans) 		PF00982
(Glyco_transf_20) 		5 ARG A 339
GLU A 153
TYR A 206
TYR A 207
VAL A 230
 None
 1.40A 4ffwB-5dxfA:
5.5		 4ffwB-5dxfA:
22.07
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.
5dzt CYLM

(Enterococcus
faecalis) 		PF05147
(LANC_like)
PF13575
(DUF4135) 		5 GLU A 976
GLY A 916
PHE A 967
TYR A 748
VAL A 706
 None
 1.27A 4ffwB-5dztA:
undetectable		 4ffwB-5dztA:
20.89
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.
5gha SULFUR CARRIER TTUB
SULFUR TRANSFERASE
TTUA

(Thermus
thermophilus) 		PF01171
(ATP_bind_3)
no annotation 		5 GLU E  33
GLY A 246
TYR A  26
SER A 208
VAL E  36
 None
None
None
None
EDO  E 101 (-4.1A)
 1.34A 4ffwB-5ghaE:
undetectable		 4ffwB-5ghaE:
8.40
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.
5gha SULFUR CARRIER TTUB
SULFUR TRANSFERASE
TTUA

(Thermus
thermophilus) 		PF01171
(ATP_bind_3)
no annotation 		5 GLU E  33
GLY A 246
TYR A  26
SER A 208
VAL E  36
 None
None
None
None
EDO  E 101 (-4.1A)
 1.48A 4ffwB-5ghaE:
undetectable		 4ffwB-5ghaE:
8.40
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.
5h0i ASPARAGINYL
ENDOPEPTIDASE

(Oldenlandia
affinis) 		PF01650
(Peptidase_C13) 		5 GLU A 440
GLY A  67
TYR A 172
VAL A 180
TYR A 188
 None
 1.43A 4ffwB-5h0iA:
undetectable		 4ffwB-5h0iA:
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.
5h42 UNCHARACTERIZED
PROTEIN

(Lachnoclostridium
phytofermentans) 		PF17167
(Glyco_hydro_36) 		5 ARG A 916
GLU A 917
GLY A 915
TYR A 969
SER A1005
 G1P  A1201 ( 4.0A)
G1P  A1201 (-3.6A)
None
None
G1P  A1201 (-2.5A)
 1.29A 4ffwB-5h42A:
undetectable		 4ffwB-5h42A:
22.12
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.
5lxv SCAFFOLDIN C

(Ruminococcus
flavefaciens) 		PF00963
(Cohesin) 		5 PHE A  20
TYR A  43
SER A  87
VAL A  89
VAL A  78
 None
 1.14A 4ffwB-5lxvA:
undetectable		 4ffwB-5lxvA:
14.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5olj DIPEPTIDYL PEPTIDASE
IV

(Porphyromonas
gingivalis) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		11 ARG A 115
GLU A 195
GLU A 196
GLY A 198
TYR A 511
SER A 593
VAL A 619
TYR A 625
TYR A 629
VAL A 671
HIS A 700
 GOL  A 801 ( 4.4A)
GOL  A 801 ( 4.6A)
None
None
GOL  A 801 (-4.4A)
GOL  A 801 (-2.5A)
None
GOL  A 801 (-4.5A)
GOL  A 801 ( 4.1A)
None
None
 0.62A 4ffwB-5oljA:
39.1		 4ffwB-5oljA:
32.00
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.
5opq 3,6-ANHYDRO-D-GALACT
OSIDASE

(Zobellia
galactanivorans) 		no annotation 5 GLU A 517
GLY A 532
SER A 426
VAL A 389
TYR A 422
 TRS  A 703 (-2.9A)
None
None
None
None
 1.43A 4ffwB-5opqA:
undetectable		 4ffwB-5opqA:
7.26
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLU A 147
GLY A 129
TYR A 246
TYR A 149
VAL A 159
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
None
 1.44A 4ffwB-5u25A:
undetectable		 4ffwB-5u25A:
21.24
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLU A 147
GLY A 228
VAL A 159
TYR A 246
VAL A 155
 FAD  A 601 (-2.8A)
FAD  A 601 (-3.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-3.8A)
 1.47A 4ffwB-5u25A:
undetectable		 4ffwB-5u25A:
21.24
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.
5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)

(Neisseria
gonorrhoeae) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.28A 4ffwB-5u25A:
undetectable		 4ffwB-5u25A:
21.24
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.
5xb7 BETA-GALACTOSIDASE

(Bifidobacterium
animalis) 		no annotation 5 GLY A 629
VAL A 277
TYR A 307
VAL A 309
HIS A 334
 None
 1.23A 4ffwB-5xb7A:
3.1		 4ffwB-5xb7A:
21.91
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.
5yp3 DIPEPTIDYL
AMINOPEPTIDASE 4

(Pseudoxanthomonas
mexicana) 		no annotation 10 ARG A 106
GLU A 208
GLU A 209
TYR A 527
SER A 613
VAL A 639
TYR A 645
TYR A 649
VAL A 692
HIS A 721
 ILE  A 801 (-4.2A)
ILE  A 801 (-3.4A)
ILE  A 801 (-2.7A)
PRO  A 802 (-4.7A)
PRO  A 802 (-1.3A)
None
PRO  A 802 (-4.0A)
PRO  A 802 (-3.8A)
None
ILE  A 801 (-4.5A)
 0.66A 4ffwB-5yp3A:
36.5		 4ffwB-5yp3A:
7.88
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.
5yp3 DIPEPTIDYL
AMINOPEPTIDASE 4

(Pseudoxanthomonas
mexicana) 		no annotation 5 GLU A 208
TYR A 527
SER A 613
VAL A 639
TYR A 645
 ILE  A 801 (-3.4A)
PRO  A 802 (-4.7A)
PRO  A 802 (-1.3A)
None
PRO  A 802 (-4.0A)
 1.06A 4ffwB-5yp3A:
36.5		 4ffwB-5yp3A:
7.88
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.
6c4n PSEUDOPALINE
DEHYDROGENASE

(Pseudomonas
aeruginosa) 		no annotation 5 GLY A  17
SER A 196
VAL A 198
TYR A 151
VAL A 170
 NAP  A 501 (-3.3A)
None
None
None
None
 1.37A 4ffwB-6c4nA:
undetectable		 4ffwB-6c4nA:
8.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6dux 6-PHOSPHO-ALPHA-GLUC
OSIDASE

(Klebsiella
pneumoniae) 		no annotation 5 GLY A  12
TYR A 118
SER A 122
VAL A 152
VAL A 126
 NAD  A 501 (-3.2A)
NAD  A 501 (-4.6A)
None
None
None
 1.27A 4ffwB-6duxA:
undetectable		 4ffwB-6duxA:
8.04
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.
6eoq DIPEPTIDYL PEPTIDASE
9

(Homo sapiens) 		no annotation 8 GLU A 249
TYR A 644
SER A 730
VAL A 756
TYR A 762
TYR A 766
VAL A 811
HIS A 840
 None
 0.56A 4ffwB-6eoqA:
29.5		 4ffwB-6eoqA:
7.14
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.
6eot DIPEPTIDYL PEPTIDASE
8

(Homo sapiens) 		no annotation 10 ARG A 160
GLU A 275
GLU A 276
TYR A 669
SER A 755
VAL A 781
TYR A 787
TYR A 791
VAL A 836
HIS A 865
 None
 0.56A 4ffwB-6eotA:
29.3		 4ffwB-6eotA:
8.72
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.
6eot DIPEPTIDYL PEPTIDASE
8

(Homo sapiens) 		no annotation 5 GLU A 275
TYR A 669
SER A 755
VAL A 781
TYR A 787
 None
 1.11A 4ffwB-6eotA:
29.3		 4ffwB-6eotA:
8.72
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.
6exs PEPTIDE ABC
TRANSPORTER PERMEASE

(Staphylococcus
hominis) 		no annotation 5 GLU A  36
GLY A 102
TYR A  79
TYR A  40
VAL A 166
 None
 1.21A 4ffwB-6exsA:
undetectable		 4ffwB-6exsA:
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.
1amk TRIOSE PHOSPHATE
ISOMERASE

(Leishmania
mexicana) 		PF00121
(TIM) 		3 ARG A 243
TYR A 223
ASN A 218
 None
 0.94A 4ffwB-1amkA:
undetectable		 4ffwB-1amkA:
14.64
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.
1d7w MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		3 ARG C 403
TYR C 334
ASN C 330
 None
HEM  A 605 ( 4.8A)
None
 0.87A 4ffwB-1d7wC:
undetectable		 4ffwB-1d7wC:
20.05
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.
1fbw ENDO-1,4-BETA-GLUCAN
ASE F

([Clostridium]
cellulolyticum) 		PF02011
(Glyco_hydro_48) 		3 ARG A 268
TYR A 393
ASN A 319
 None
 0.79A 4ffwB-1fbwA:
0.0		 4ffwB-1fbwA:
20.94
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.
1fbw ENDO-1,4-BETA-GLUCAN
ASE F

([Clostridium]
cellulolyticum) 		PF02011
(Glyco_hydro_48) 		3 ARG A 277
TYR A 294
ASN A 319
 None
 0.89A 4ffwB-1fbwA:
0.0		 4ffwB-1fbwA:
20.94
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.
1h17 FORMATE
ACETYLTRANSFERASE 1

(Escherichia
coli) 		PF01228
(Gly_radical)
PF02901
(PFL-like) 		3 ARG A 731
TYR A 725
ASN A  65
 None
 0.96A 4ffwB-1h17A:
0.0		 4ffwB-1h17A:
20.84
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.
1irx LYSYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF01921
(tRNA-synt_1f) 		3 ARG A  72
TYR A  33
ASN A  38
 None
 0.82A 4ffwB-1irxA:
0.2		 4ffwB-1irxA:
22.00
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.
1jro XANTHINE
DEHYDROGENASE, CHAIN
A

(Rhodobacter
capsulatus) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01799
(Fer2_2)
PF03450
(CO_deh_flav_C) 		3 ARG A  58
TYR A 125
ASN A 132
 None
 0.81A 4ffwB-1jroA:
undetectable		 4ffwB-1jroA:
19.11
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.
1lar PROTEIN (LAR)

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 ARG A1354
TYR A1361
ASN A1345
 None
 0.82A 4ffwB-1larA:
2.6		 4ffwB-1larA:
21.64
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.
1qho ALPHA-AMYLASE

(Geobacillus
stearothermophilus) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		3 ARG A 413
TYR A 443
ASN A 468
 None
 0.73A 4ffwB-1qhoA:
0.0		 4ffwB-1qhoA:
23.27
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.
1r8g HYPOTHETICAL PROTEIN
YBDK

(Escherichia
coli) 		PF04107
(GCS2) 		3 ARG A 182
TYR A 290
ASN A 343
 None
 0.72A 4ffwB-1r8gA:
undetectable		 4ffwB-1r8gA:
18.24
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.
1vdc NADPH DEPENDENT
THIOREDOXIN
REDUCTASE

(Arabidopsis
thaliana) 		PF07992
(Pyr_redox_2) 		3 ARG A 144
TYR A 172
ASN A 193
 None
 0.73A 4ffwB-1vdcA:
undetectable		 4ffwB-1vdcA:
18.74
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.
1w6j LANOSTEROL SYNTHASE

(Homo sapiens) 		PF13243
(SQHop_cyclase_C)
PF13249
(SQHop_cyclase_N) 		3 ARG A 435
TYR A 528
ASN A 495
 None
 0.88A 4ffwB-1w6jA:
undetectable		 4ffwB-1w6jA:
23.17
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.
1w99 PESTICIDIAL CRYSTAL
PROTEIN CRY4BA

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		3 ARG A 289
TYR A 347
ASN A 473
 None
 0.65A 4ffwB-1w99A:
undetectable		 4ffwB-1w99A:
21.63
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.
1woi AGMATINASE

(Deinococcus
radiodurans) 		PF00491
(Arginase) 		3 ARG A 164
TYR A 225
ASN A 172
 None
 0.86A 4ffwB-1woiA:
undetectable		 4ffwB-1woiA:
14.70
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.
1xbr PROTEIN (T PROTEIN)

(Xenopus laevis) 		PF00907
(T-box) 		3 ARG A  68
TYR A 164
ASN A  58
 None
 0.69A 4ffwB-1xbrA:
undetectable		 4ffwB-1xbrA:
12.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yrz XYLAN
BETA-1,4-XYLOSIDASE

(Bacillus
halodurans) 		PF04616
(Glyco_hydro_43) 		3 ARG A1051
TYR A1523
ASN A1337
 None
 0.94A 4ffwB-1yrzA:
6.1		 4ffwB-1yrzA:
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.
1zpu IRON TRANSPORT
MULTICOPPER OXIDASE
FET3

(Saccharomyces
cerevisiae) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		3 ARG A 212
TYR A 133
ASN A 195
 None
 0.75A 4ffwB-1zpuA:
undetectable		 4ffwB-1zpuA:
21.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2buc DIPEPTIDYL PEPTIDASE
IV

(Sus scrofa) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 ARG A 358
TYR A 631
ASN A 710
 008  A1767 ( 4.0A)
None
008  A1767 (-3.0A)
 0.80A 4ffwB-2bucA:
51.3		 4ffwB-2bucA:
81.92
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.
2bzl TYROSINE-PROTEIN
PHOSPHATASE,
NON-RECEPTOR TYPE 14

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 ARG A1154
TYR A 979
ASN A 948
 None
 0.88A 4ffwB-2bzlA:
undetectable		 4ffwB-2bzlA:
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.
2c9k PESTICIDAL CRYSTAL
PROTEIN CRY4AA

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		3 ARG A 328
TYR A 389
ASN A 531
 None
 0.71A 4ffwB-2c9kA:
undetectable		 4ffwB-2c9kA:
22.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2g5t DIPEPTIDYL PEPTIDASE
4

(Homo sapiens) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 ARG A 358
TYR A 631
ASN A 710
 None
None
ACF  A 800 (-3.3A)
 0.48A 4ffwB-2g5tA:
51.6		 4ffwB-2g5tA:
84.50
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.
2gj7 GLYCOPROTEIN E

(Human
alphaherpesvirus
1) 		no annotation 3 ARG F 316
TYR F 311
ASN F 364
 None
 0.66A 4ffwB-2gj7F:
undetectable		 4ffwB-2gj7F:
19.21
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		3 ARG A 591
TYR A 563
ASN A 605
 None
 0.86A 4ffwB-2i0kA:
undetectable		 4ffwB-2i0kA:
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.
2iqf CATALASE

(Helicobacter
pylori) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		3 ARG A 101
TYR A 339
ASN A 357
 None
HEM  A 550 (-3.8A)
None
 0.55A 4ffwB-2iqfA:
undetectable		 4ffwB-2iqfA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2isa CATALASE

(Aliivibrio
salmonicida) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		3 ARG A  99
TYR A 337
ASN A 355
 None
HEM  A 486 (-4.1A)
None
 0.73A 4ffwB-2isaA:
undetectable		 4ffwB-2isaA:
20.81
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.
2jgz CELL DIVISION
PROTEIN KINASE 2
G2/MITOTIC-SPECIFIC
CYCLIN-B1

(Homo sapiens) 		PF00069
(Pkinase)
PF00134
(Cyclin_N)
PF02984
(Cyclin_C) 		3 ARG B 308
TYR A 179
ASN A 272
 None
 0.91A 4ffwB-2jgzB:
undetectable		 4ffwB-2jgzB:
15.87
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.
2nyf NOSTOC PUNCTIFORME
PHENYLALANINE
AMMONIA LYASE

(Nostoc
punctiforme) 		PF00221
(Lyase_aromatic) 		3 ARG A 128
TYR A 160
ASN A 463
 None
 0.75A 4ffwB-2nyfA:
undetectable		 4ffwB-2nyfA:
21.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2oae DIPEPTIDYL PEPTIDASE
4

(Rattus
norvegicus) 		PF00326
(Peptidase_S9)
PF00930
(DPPIV_N) 		3 ARG A 356
TYR A 632
ASN A 711
 AIL  A 901 ( 4.7A)
None
AIL  A 901 (-3.1A)
 0.53A 4ffwB-2oaeA:
52.2		 4ffwB-2oaeA:
100.00
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.
2q42 PUTATIVE
HYDROXYACYLGLUTATHIO
NE HYDROLASE 2

(Arabidopsis
thaliana) 		PF00753
(Lactamase_B)
PF16123
(HAGH_C) 		3 ARG A  69
TYR A  49
ASN A  52
 None
 0.93A 4ffwB-2q42A:
undetectable		 4ffwB-2q42A:
15.49
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.
2rdy BH0842 PROTEIN

(Bacillus
halodurans) 		PF14498
(Glyco_hyd_65N_2) 		3 ARG A  66
TYR A 516
ASN A 576
 None
 0.93A 4ffwB-2rdyA:
undetectable		 4ffwB-2rdyA:
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.
2vpw THIOSULFATE
REDUCTASE

(Thermus
thermophilus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		3 ARG A 343
TYR A 202
ASN A 356
 None
 0.75A 4ffwB-2vpwA:
undetectable		 4ffwB-2vpwA:
21.57
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.
2vrk ALPHA-L-ARABINOFURAN
OSIDASE

(Thermobacillus
xylanilyticus) 		PF06964
(Alpha-L-AF_C) 		3 ARG A 339
TYR A  23
ASN A 344
 None
 0.95A 4ffwB-2vrkA:
undetectable		 4ffwB-2vrkA:
21.51
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.
2w6d DYNAMIN FAMILY
PROTEIN

(Nostoc
punctiforme) 		PF00350
(Dynamin_N) 		3 ARG A 264
TYR A 274
ASN A 281
 None
 0.67A 4ffwB-2w6dA:
undetectable		 4ffwB-2w6dA:
21.57
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.
2zat DEHYDROGENASE/REDUCT
ASE SDR FAMILY
MEMBER 4

(Sus scrofa) 		PF13561
(adh_short_C2) 		3 ARG A 185
TYR A 244
ASN A 190
 None
 0.93A 4ffwB-2zatA:
undetectable		 4ffwB-2zatA:
16.16
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.
2zyl POSSIBLE
OXIDOREDUCTASE

(Mycobacterium
tuberculosis) 		PF00355
(Rieske) 		3 ARG A 313
TYR A 260
ASN A 257
 None
 0.91A 4ffwB-2zylA:
undetectable		 4ffwB-2zylA:
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.
3b8i PA4872 OXALOACETATE
DECARBOXYLASE

(Pseudomonas
aeruginosa) 		PF13714
(PEP_mutase) 		3 ARG A 222
TYR A  23
ASN A 233
 None
 0.72A 4ffwB-3b8iA:
undetectable		 4ffwB-3b8iA:
15.59
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.
3ctt MALTASE-GLUCOAMYLASE

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		3 ARG A 471
TYR A 214
ASN A 498
 None
 0.73A 4ffwB-3cttA:
undetectable		 4ffwB-3cttA:
22.04
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.
3dfh MANDELATE RACEMASE

(Vibrionales
bacterium
SWAT-3) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ARG A 153
TYR A 358
ASN A 326
 None
 0.90A 4ffwB-3dfhA:
undetectable		 4ffwB-3dfhA:
19.08
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.
3egw RESPIRATORY NITRATE
REDUCTASE 1 BETA
CHAIN

(Escherichia
coli) 		PF13247
(Fer4_11)
PF14711
(Nitr_red_bet_C) 		3 ARG B 404
TYR B 415
ASN B 374
 None
 0.92A 4ffwB-3egwB:
undetectable		 4ffwB-3egwB:
20.50
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.
3eh1 PROTEIN TRANSPORT
PROTEIN SEC24B

(Homo sapiens) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 ARG A 925
TYR A 630
ASN A 633
 None
 0.56A 4ffwB-3eh1A:
undetectable		 4ffwB-3eh1A:
21.91
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.
3gyx ADENYLYLSULFATE
REDUCTASE

(Desulfovibrio
gigas) 		PF00890
(FAD_binding_2) 		3 ARG A 336
TYR A 413
ASN A 276
 None
 0.79A 4ffwB-3gyxA:
undetectable		 4ffwB-3gyxA:
21.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h77 PQS BIOSYNTHETIC
ENZYME

(Pseudomonas
aeruginosa) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		3 ARG A 109
TYR A 315
ASN A 287
 None
None
CSJ  A 112 ( 3.8A)
 0.85A 4ffwB-3h77A:
undetectable		 4ffwB-3h77A:
19.01
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.
3i9v NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 3
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 4
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 5

(Thermus
thermophilus) 		PF00329
(Complex1_30kDa)
PF00346
(Complex1_49kDa)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4)
PF10588
(NADH-G_4Fe-4S_3)
PF13510
(Fer2_4) 		3 ARG 5 189
TYR 3 140
ASN 4 306
 None
 0.91A 4ffwB-3i9v5:
undetectable		 4ffwB-3i9v5:
14.99
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.
3izy TRANSLATION
INITIATION FACTOR
IF-2, MITOCHONDRIAL

(Bos taurus) 		PF00009
(GTP_EFTU)
PF11987
(IF-2) 		3 ARG P 397
TYR P 411
ASN P 403
 None
 0.95A 4ffwB-3izyP:
undetectable		 4ffwB-3izyP:
20.59
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.
3jq0 SUSD SUPERFAMILY
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 ARG A  87
TYR A 103
ASN A  60
 None
 0.94A 4ffwB-3jq0A:
undetectable		 4ffwB-3jq0A:
21.48
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.
3kjx TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Ruegeria
pomeroyi) 		PF00356
(LacI)
PF00532
(Peripla_BP_1) 		3 ARG A 200
TYR A 251
ASN A 281
 None
 0.94A 4ffwB-3kjxA:
2.8		 4ffwB-3kjxA:
19.73
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.
3lew SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
vulgatus) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 ARG A 492
TYR A  66
ASN A  63
 None
 0.96A 4ffwB-3lewA:
undetectable		 4ffwB-3lewA:
20.38
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.
3snx PUTATIVE SUSD-LIKE
CARBOHYDRATE BINDING
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		3 ARG A 107
TYR A 116
ASN A  56
 None
 0.89A 4ffwB-3snxA:
undetectable		 4ffwB-3snxA:
19.73
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.
3tzq SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE

(Mycobacterium
marinum) 		no annotation 3 ARG B 116
TYR B 168
ASN B 139
 None
 0.93A 4ffwB-3tzqB:
3.1		 4ffwB-3tzqB:
17.93
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.
3wew HTDX DEHYDRATASE

(Mycobacterium
tuberculosis) 		PF01575
(MaoC_dehydratas) 		3 ARG A 147
TYR A 223
ASN A 195
 None
 0.97A 4ffwB-3wewA:
undetectable		 4ffwB-3wewA:
15.57
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.
3wih ANTI-HUMAN ROBO1
ANTIBODY B2212A FAB
HEAVY CHAIN
ROUNDABOUT HOMOLOG 1

(Homo sapiens;
Mus musculus) 		PF00041
(fn3)
PF07654
(C1-set)
PF07686
(V-set) 		3 ARG A  50
TYR H  32
ASN H  35
 None
 0.86A 4ffwB-3wihA:
undetectable		 4ffwB-3wihA:
10.09
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.
4a0l CULLIN-4B

(Homo sapiens) 		PF00888
(Cullin)
PF10557
(Cullin_Nedd8) 		3 ARG E 889
TYR E 598
ASN E 557
 None
 0.84A 4ffwB-4a0lE:
undetectable		 4ffwB-4a0lE:
22.33
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.
4aw7 GH86A
BETA-PORPHYRANASE

(Bacteroides
plebeius) 		no annotation 3 ARG A 217
TYR A 237
ASN A 253
 CL  A1615 ( 4.7A)
GLA  A1608 (-4.0A)
None
 0.70A 4ffwB-4aw7A:
2.0		 4ffwB-4aw7A:
21.54
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.
4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE

(Ralstonia sp.
DSMZ 6428) 		PF13561
(adh_short_C2) 		3 ARG A 171
TYR A 234
ASN A 176
 None
 0.89A 4ffwB-4bmsA:
undetectable		 4ffwB-4bmsA:
15.41
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.
4bpc RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE S

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 ARG A1421
TYR A1428
ASN A1412
 None
 0.82A 4ffwB-4bpcA:
undetectable		 4ffwB-4bpcA:
20.73
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.
4dun PUTATIVE PHENAZINE
BIOSYNTHESIS
PHZC/PHZF PROTEIN

(Clostridioides
difficile) 		PF02567
(PhzC-PhzF) 		3 ARG A  58
TYR A   4
ASN A  40
 None
 0.94A 4ffwB-4dunA:
undetectable		 4ffwB-4dunA:
15.49
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.
4e37 CATALASE

(Pseudomonas
aeruginosa) 		PF00199
(Catalase)
PF06628
(Catalase-rel) 		3 ARG A 100
TYR A 338
ASN A 356
 None
HEM  A 500 (-4.0A)
None
 0.53A 4ffwB-4e37A:
undetectable		 4ffwB-4e37A:
20.19
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.
4fas HYDROXYLAMINE
OXIDOREDUCTASE

(Nitrosomonas
europaea) 		PF13447
(Multi-haem_cyto) 		3 ARG A 165
TYR A 208
ASN A 241
 None
None
HEC  A 605 (-3.5A)
 0.90A 4ffwB-4fasA:
undetectable		 4ffwB-4fasA:
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.
4fff LEVAN
FRUCTOTRANSFERASE

(Paenarthrobacter
ureafaciens) 		PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C) 		3 ARG A  57
TYR A 298
ASN A 341
 None
 0.81A 4ffwB-4fffA:
6.7		 4ffwB-4fffA:
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.
4gis ENOLASE

(Vibrio harveyi) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 ARG A 151
TYR A 356
ASN A 324
 None
 0.96A 4ffwB-4gisA:
undetectable		 4ffwB-4gisA:
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.
4hq6 ACETYL-COA
CARBOXYLASE 2

(Homo sapiens) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		3 ARG A 281
TYR A 683
ASN A 673
 None
 0.95A 4ffwB-4hq6A:
undetectable		 4ffwB-4hq6A:
22.16
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.
4hw8 BACTERIAL
EXTRACELLULAR
SOLUTE-BINDING
PROTEIN, PUTATIVE

(Staphylococcus
aureus) 		PF13416
(SBP_bac_8) 		3 ARG A 306
TYR A 201
ASN A 196
 None
None
MAL  A 506 (-3.7A)
 0.73A 4ffwB-4hw8A:
undetectable		 4ffwB-4hw8A:
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.
4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE

(Escherichia
coli) 		PF03331
(LpxC) 		3 ARG A 237
TYR A 261
ASN A 268
 None
FMT  A 415 (-3.4A)
None
 0.91A 4ffwB-4isaA:
undetectable		 4ffwB-4isaA:
17.71
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.
4ks9 MALONYL-COA
DECARBOXYLASE

(Cupriavidus
metallidurans) 		PF05292
(MCD)
PF17408
(MCD_N) 		3 ARG A 467
TYR A 444
ASN A 454
 None
 0.95A 4ffwB-4ks9A:
undetectable		 4ffwB-4ks9A:
20.50
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.
4oj5 TAILSPIKE PROTEIN

(Escherichia
virus CBA120) 		no annotation 3 ARG A 467
TYR A 551
ASN A 531
 None
 0.82A 4ffwB-4oj5A:
undetectable		 4ffwB-4oj5A:
22.91
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.
4psw HISTONE
ACETYLTRANSFERASE
TYPE B CATALYTIC
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00583
(Acetyltransf_1)
PF10394
(Hat1_N) 		3 ARG A 267
TYR A 278
ASN A 318
 COA  A 401 (-3.2A)
None
None
 0.87A 4ffwB-4pswA:
2.5		 4ffwB-4pswA:
19.14
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.
4q00 FERROUS IRON
TRANSPORT PROTEIN B

(Escherichia
coli) 		PF02421
(FeoB_N) 		3 ARG A 140
TYR A 103
ASN A  91
 None
 0.86A 4ffwB-4q00A:
3.0		 4ffwB-4q00A:
15.89
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.
4tz5 PUTATIVE SECRETED
PROTEIN

(Streptomyces
sp. SirexAA-E) 		no annotation 3 ARG A 551
TYR A 485
ASN A 501
 None
 0.82A 4ffwB-4tz5A:
undetectable		 4ffwB-4tz5A:
20.73
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.
4w5z CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18) 		3 ARG A  44
TYR A 284
ASN A 221
 None
None
MPD  A 402 ( 4.6A)
 0.61A 4ffwB-4w5zA:
undetectable		 4ffwB-4w5zA:
18.89
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.
4xgu PUTATIVE PACHYTENE
CHECKPOINT PROTEIN 2

(Caenorhabditis
elegans) 		PF00004
(AAA) 		3 ARG A 340
TYR A 328
ASN A 138
 None
 0.76A 4ffwB-4xguA:
undetectable		 4ffwB-4xguA:
20.70
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.
4xwl EXOGLUCANASE S

(Clostridium
cellulovorans) 		PF02011
(Glyco_hydro_48) 		3 ARG A 260
TYR A 385
ASN A 311
 None
P33  A 705 (-3.9A)
None
 0.78A 4ffwB-4xwlA:
undetectable		 4ffwB-4xwlA:
20.77
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.
4xwl EXOGLUCANASE S

(Clostridium
cellulovorans) 		PF02011
(Glyco_hydro_48) 		3 ARG A 269
TYR A 286
ASN A 311
 None
 0.83A 4ffwB-4xwlA:
undetectable		 4ffwB-4xwlA:
20.77
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.
5a3k PUTATIVE
PTERIDINE-DEPENDENT
DIOXYGENASE

(Streptomyces
hygroscopicus) 		no annotation 3 ARG A 290
TYR A  36
ASN A  17
 None
 0.96A 4ffwB-5a3kA:
undetectable		 4ffwB-5a3kA:
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.
5dzt CYLM

(Enterococcus
faecalis) 		PF05147
(LANC_like)
PF13575
(DUF4135) 		3 ARG A 979
TYR A 705
ASN A 757
 None
 0.86A 4ffwB-5dztA:
undetectable		 4ffwB-5dztA:
20.89
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.
5e6p PLEXIN-B2

(Mus musculus) 		PF08337
(Plexin_cytopl) 		3 ARG A1783
TYR A1369
ASN A1328
 None
 0.96A 4ffwB-5e6pA:
undetectable		 4ffwB-5e6pA:
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.
5epz ANGIOGENIN

(Homo sapiens) 		PF00074
(RnaseA) 		3 ARG A   5
TYR A  14
ASN A  43
 None
 0.89A 4ffwB-5epzA:
undetectable		 4ffwB-5epzA:
10.10
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.
5eyb DNA-BINDING PROTEIN
REB1

(Schizosaccharomyces
pombe) 		PF00249
(Myb_DNA-binding) 		3 ARG A 313
TYR A 307
ASN A 269
 None
 0.89A 4ffwB-5eybA:
undetectable		 4ffwB-5eybA:
17.51
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.
5gmx CARBOXYLESTERASE

(uncultured
bacterium) 		PF00144
(Beta-lactamase) 		3 ARG A 304
TYR A 279
ASN A 335
 None
 0.93A 4ffwB-5gmxA:
undetectable		 4ffwB-5gmxA:
19.95
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.
5h08 RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE ZETA

(Homo sapiens) 		PF00102
(Y_phosphatase) 		3 ARG A1755
TYR A1762
ASN A1746
 None
 0.75A 4ffwB-5h08A:
undetectable		 4ffwB-5h08A:
17.67
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.
5h9x BETA-1,3-GLUCANASE

(Paenibacillus
barengoltzii) 		PF16483
(Glyco_hydro_64) 		3 ARG A 197
TYR A 207
ASN A 162
 None
 0.97A 4ffwB-5h9xA:
undetectable		 4ffwB-5h9xA:
19.73
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.
5ldt MOMP PORIN

(Campylobacter
jejuni) 		PF05538
(Campylo_MOMP) 		3 ARG A 316
TYR A 250
ASN A 238
 None
 0.96A 4ffwB-5ldtA:
undetectable		 4ffwB-5ldtA:
20.55
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.
5lzl DELTA-AMINOLEVULINIC
ACID DEHYDRATASE

(Pyrobaculum
calidifontis) 		PF00490
(ALAD) 		3 ARG A 302
TYR A  35
ASN A 282
 None
 0.85A 4ffwB-5lzlA:
undetectable		 4ffwB-5lzlA:
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.
5mfa MYELOPEROXIDASE

(Homo sapiens) 		PF03098
(An_peroxidase) 		3 ARG A 569
TYR A 500
ASN A 496
 None
HEM  A 812 ( 4.3A)
None
 0.86A 4ffwB-5mfaA:
undetectable		 4ffwB-5mfaA:
23.23
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.
5mhj MAJOR VIRAL
TRANSCRIPTION FACTOR
ICP4

(Human
alphaherpesvirus
1) 		PF03584
(Herpes_ICP4_N) 		3 ARG A 471
TYR A 373
ASN A 482
 None
None
ACY  A 501 (-3.3A)
 0.88A 4ffwB-5mhjA:
undetectable		 4ffwB-5mhjA:
13.50
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.
5mhk RS1

(Human
alphaherpesvirus
1) 		PF03584
(Herpes_ICP4_N) 		3 ARG A 471
TYR A 373
ASN A 482
 SO4  A 501 (-3.1A)
None
None
 0.87A 4ffwB-5mhkA:
undetectable		 4ffwB-5mhkA:
14.49
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.
5mqs BETA-L-ARABINOBIOSID
ASE

(Bacteroides
thetaiotaomicron) 		PF13088
(BNR_2) 		3 ARG A1077
TYR A 346
ASN A 350
 None
 0.79A 4ffwB-5mqsA:
3.7		 4ffwB-5mqsA:
21.36
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.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		3 ARG A 197
TYR A 270
ASN A 413
 None
 0.97A 4ffwB-5n6uA:
undetectable		 4ffwB-5n6uA:
21.99
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.
5vni PROTEIN TRANSPORT
PROTEIN SEC24A

(Homo sapiens) 		PF00626
(Gelsolin)
PF04810
(zf-Sec23_Sec24)
PF04811
(Sec23_trunk)
PF04815
(Sec23_helical)
PF08033
(Sec23_BS) 		3 ARG B 750
TYR B 456
ASN B 459
 None
 0.71A 4ffwB-5vniB:
3.7		 4ffwB-5vniB:
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.
5w76 ANCESTRAL ELOGATION
FACTOR N153

(synthetic
construct) 		no annotation 3 ARG A 124
TYR A  88
ASN A 356
 None
 0.90A 4ffwB-5w76A:
3.5		 4ffwB-5w76A:
7.42
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.
5wva SHORT-CHAIN
DEHYDROGENASE

(Serratia
marcescens) 		no annotation 3 ARG A 179
TYR A 235
ASN A 184
 None
 0.84A 4ffwB-5wvaA:
2.9		 4ffwB-5wvaA:
6.74
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.
5xa1 INOSITOL
1,4,5-TRISPHOSPHATE
RECEPTOR TYPE 1

(Mus musculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		3 ARG A 148
TYR A  66
ASN A 188
 None
 0.76A 4ffwB-5xa1A:
undetectable		 4ffwB-5xa1A:
18.79
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.
5xez GLUCAGON
RECEPTOR,ENDOLYSIN,G
LUCAGON RECEPTOR

(Escherichia
virus T4;
Homo sapiens) 		PF00002
(7tm_2)
PF00959
(Phage_lysozyme)
PF02793
(HRM) 		3 ARG A 413
TYR A 343
ASN A 174
 None
 0.87A 4ffwB-5xezA:
undetectable		 4ffwB-5xezA:
20.63
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.
5xzb CYCLIC GMP-AMP
SYNTHASE

(Mus musculus) 		PF03281
(Mab-21) 		3 ARG A 158
TYR A 201
ASN A 376
 None
 0.90A 4ffwB-5xzbA:
undetectable		 4ffwB-5xzbA:
18.54
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.
5yvs ALCOHOL
DEHYDROGENASE

(candidate
divison MSBL1
archaeon
SCGC-AAA259E19) 		no annotation 3 ARG A 272
TYR A 283
ASN A  71
 None
None
NDP  A 502 (-3.4A)
 0.76A 4ffwB-5yvsA:
undetectable		 4ffwB-5yvsA:
8.55
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 3 ARG A 518
TYR A 556
ASN A 577
 None
 0.92A 4ffwB-5z06A:
undetectable		 4ffwB-5z06A:
8.36
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.
6azp MYELOPEROXIDASE

(Homo sapiens) 		no annotation 3 ARG A 569
TYR A 500
ASN A 496
 None
 0.84A 4ffwB-6azpA:
undetectable		 4ffwB-6azpA:
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.
6bli CB002.5 FAB HEAVY
CHAIN

(Homo sapiens) 		no annotation 3 ARG A 100
TYR A  32
ASN A  35
 None
 0.75A 4ffwB-6bliA:
undetectable		 4ffwB-6bliA:
7.54
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.
6c08 SODIUM-COUPLED
NEUTRAL AMINO ACID
TRANSPORTER 9

(Danio rerio) 		no annotation 3 ARG C 495
TYR C 204
ASN C 210
 None
 0.86A 4ffwB-6c08C:
undetectable		 4ffwB-6c08C:
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.
6c93 CYTOCHROME P450 4B1

(Oryctolagus
cuniculus) 		no annotation 3 ARG A 259
TYR A 206
ASN A 200
 None
 0.90A 4ffwB-6c93A:
undetectable		 4ffwB-6c93A:
8.75
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.
6fnw VOLUME-REGULATED
ANION CHANNEL
SUBUNIT LRRC8A

(Mus musculus) 		no annotation 3 ARG A 600
TYR A 668
ASN A 672
 None
EDO  A 902 (-3.9A)
None
 0.94A 4ffwB-6fnwA:
2.6		 4ffwB-6fnwA:
12.86