SIMILAR PATTERNS OF AMINO ACIDS FOR 1DBB_H_STRH229_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.
1axk GLUXYN-1

(Bacillus
subtilis) 		PF00457
(Glyco_hydro_11)
PF00722
(Glyco_hydro_16) 		4 GLY A 169
GLY A 190
TRP A 186
VAL A 194
 None
 0.92A 1dbbH-1axkA:
undetectable
1dbbL-1axkA:
0.0		 1dbbH-1axkA:
22.31
1dbbL-1axkA:
19.63
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.
1d5t GUANINE NUCLEOTIDE
DISSOCIATION
INHIBITOR

(Bos taurus) 		PF00996
(GDI) 		4 GLY A  13
GLY A  41
TYR A 404
VAL A 287
 None
 0.78A 1dbbH-1d5tA:
undetectable
1dbbL-1d5tA:
undetectable		 1dbbH-1d5tA:
19.77
1dbbL-1d5tA:
19.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1dbj IGG1-KAPPA DB3 FAB
(HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		6 GLY H  33
ASN H  35
TRP H  50
GLY H  95
TYR H  97
TRP H 100
 AE2  H 229 (-3.5A)
AE2  H 229 (-2.9A)
AE2  H 229 (-4.2A)
AE2  H 229 (-3.2A)
AE2  H 229 ( 4.2A)
AE2  H 229 (-3.9A)
 0.54A 1dbbH-1dbjH:
29.0
1dbbL-1dbjH:
17.6		 1dbbH-1dbjH:
100.00
1dbbL-1dbjH:
28.99
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.
1dms DMSO REDUCTASE

(Rhodobacter
capsulatus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		4 GLY A 364
TRP A 171
GLY A 363
TYR A 358
 None
 0.91A 1dbbH-1dmsA:
0.3
1dbbL-1dmsA:
undetectable		 1dbbH-1dmsA:
13.06
1dbbL-1dmsA:
14.05
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.
1exh EXO-1,4-BETA-D-GLYCA
NASE

(Cellulomonas
fimi) 		PF00553
(CBM_2) 		4 GLY A  37
ASN A  69
GLY A  74
VAL A  10
 None
 0.85A 1dbbH-1exhA:
2.7
1dbbL-1exhA:
3.1		 1dbbH-1exhA:
19.82
1dbbL-1exhA:
18.69
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.
1hdi PHOSPHOGLYCERATE
KINASE

(Sus scrofa) 		PF00162
(PGK) 		4 GLY A 337
TRP A 335
GLY A 212
VAL A 327
 None
 0.87A 1dbbH-1hdiA:
undetectable
1dbbL-1hdiA:
undetectable		 1dbbH-1hdiA:
19.95
1dbbL-1hdiA:
20.44
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.
1jmz AMINE DEHYDROGENASE

(Pseudomonas
putida) 		no annotation 4 GLY B  44
ASN B  61
GLY B  46
TYR B  19
 None
 0.83A 1dbbH-1jmzB:
undetectable
1dbbL-1jmzB:
undetectable		 1dbbH-1jmzB:
19.49
1dbbL-1jmzB:
23.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1js4 ENDO/EXOCELLULASE E4

(Thermobifida
fusca) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		4 GLY A 552
GLY A 551
TRP A 128
HIS A 376
 None
 0.78A 1dbbH-1js4A:
3.0
1dbbL-1js4A:
2.9		 1dbbH-1js4A:
17.28
1dbbL-1js4A:
16.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jsc ACETOHYDROXY-ACID
SYNTHASE

(Saccharomyces
cerevisiae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 GLY A 356
ASN A 361
GLY A 353
VAL A 303
 FAD  A 701 (-4.6A)
None
FAD  A 701 (-3.5A)
None
 0.92A 1dbbH-1jscA:
undetectable
1dbbL-1jscA:
undetectable		 1dbbH-1jscA:
17.69
1dbbL-1jscA:
16.32
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.
1jsx GLUCOSE-INHIBITED
DIVISION PROTEIN B

(Escherichia
coli) 		PF02527
(GidB) 		4 GLY A  77
GLY A  80
TYR A  27
HIS A  19
 None
 0.89A 1dbbH-1jsxA:
undetectable
1dbbL-1jsxA:
undetectable		 1dbbH-1jsxA:
20.94
1dbbL-1jsxA:
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.
1k72 ENDOGLUCANASE 9G

([Clostridium]
cellulolyticum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		4 GLY A 556
GLY A 555
TRP A 128
HIS A 373
 None
None
None
CBI  A 777 (-4.1A)
 0.72A 1dbbH-1k72A:
2.8
1dbbL-1k72A:
3.0		 1dbbH-1k72A:
18.44
1dbbL-1k72A:
16.12
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.
1leh LEUCINE
DEHYDROGENASE

(Lysinibacillus
sphaericus) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 GLY A  78
ASN A  69
GLY A  77
VAL A 294
 None
 0.81A 1dbbH-1lehA:
undetectable
1dbbL-1lehA:
undetectable		 1dbbH-1lehA:
20.16
1dbbL-1lehA:
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.
1ltd FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae) 		PF00173
(Cyt-b5)
PF01070
(FMN_dh) 		4 GLY A 375
ASN A 157
GLY A 374
VAL A 387
 None
None
FMN  A 570 (-3.3A)
None
 0.86A 1dbbH-1ltdA:
undetectable
1dbbL-1ltdA:
undetectable		 1dbbH-1ltdA:
17.79
1dbbL-1ltdA:
18.53
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.
1nff PUTATIVE
OXIDOREDUCTASE
RV2002

(Mycobacterium
tuberculosis) 		PF13561
(adh_short_C2) 		4 ASN A  88
GLY A  20
HIS A  59
VAL A  62
 NAD  A1300 (-3.3A)
None
None
NAD  A1300 (-3.5A)
 0.91A 1dbbH-1nffA:
undetectable
1dbbL-1nffA:
undetectable		 1dbbH-1nffA:
22.26
1dbbL-1nffA:
18.59
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.
1pk9 PURINE NUCLEOSIDE
PHOSPHORYLASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		4 GLY A 108
GLY A 106
HIS A  97
VAL A  94
 None
 0.85A 1dbbH-1pk9A:
undetectable
1dbbL-1pk9A:
undetectable		 1dbbH-1pk9A:
22.99
1dbbL-1pk9A:
20.32
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.
1pox PYRUVATE OXIDASE

(Lactobacillus
plantarum) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 GLY A  31
TYR A  53
HIS A 464
VAL A 458
 None
 0.91A 1dbbH-1poxA:
undetectable
1dbbL-1poxA:
undetectable		 1dbbH-1poxA:
15.04
1dbbL-1poxA:
15.40
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.
1qcw FLAVOCYTOCHROME B2

(Saccharomyces
cerevisiae) 		PF01070
(FMN_dh) 		4 GLY A 375
ASN A 157
GLY A 374
VAL A 387
 None
None
FNS  A 570 (-3.2A)
None
 0.84A 1dbbH-1qcwA:
undetectable
1dbbL-1qcwA:
undetectable		 1dbbH-1qcwA:
19.18
1dbbL-1qcwA:
20.24
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.
1qfj PROTEIN (FLAVIN
REDUCTASE)

(Escherichia
coli) 		PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6) 		4 GLY A 138
TRP A 137
GLY A 139
VAL A  17
 None
 0.92A 1dbbH-1qfjA:
undetectable
1dbbL-1qfjA:
undetectable		 1dbbH-1qfjA:
20.31
1dbbL-1qfjA:
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.
1qpg 3-PHOSPHOGLYCERATE
KINASE

(Saccharomyces
cerevisiae) 		PF00162
(PGK) 		4 GLY A 335
TRP A 333
GLY A 210
VAL A 325
 MAP  A 450 (-3.7A)
None
None
None
 0.89A 1dbbH-1qpgA:
undetectable
1dbbL-1qpgA:
undetectable		 1dbbH-1qpgA:
19.37
1dbbL-1qpgA:
21.03
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.
1qz9 KYNURENINASE

(Pseudomonas
fluorescens) 		PF00266
(Aminotran_5) 		4 GLY A 352
TYR A 368
HIS A 344
VAL A 333
 None
 0.88A 1dbbH-1qz9A:
undetectable
1dbbL-1qz9A:
undetectable		 1dbbH-1qz9A:
19.70
1dbbL-1qz9A:
19.85
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.
1sva SIMIAN VIRUS 40

(Macaca mulatta
polyomavirus 1) 		PF00718
(Polyoma_coat) 		4 GLY 1 156
GLY 1 155
TYR 1 260
VAL 1  47
 None
 0.90A 1dbbH-1sva1:
undetectable
1dbbL-1sva1:
undetectable		 1dbbH-1sva1:
18.48
1dbbL-1sva1:
20.00
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.
1t35 HYPOTHETICAL PROTEIN
YVDD, PUTATIVE
LYSINE DECARBOXYLASE

(Bacillus
subtilis) 		PF03641
(Lysine_decarbox) 		4 GLY A 107
GLY A 109
TYR A 111
VAL A   6
 SO4  A 192 (-3.5A)
SO4  A 192 (-3.1A)
None
None
 0.89A 1dbbH-1t35A:
undetectable
1dbbL-1t35A:
undetectable		 1dbbH-1t35A:
22.32
1dbbL-1t35A:
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.
1um1 KIAA1849 PROTEIN

(Homo sapiens) 		PF00595
(PDZ) 		4 GLY A  84
ASN A  65
GLY A  85
VAL A  12
 None
 0.88A 1dbbH-1um1A:
undetectable
1dbbL-1um1A:
undetectable		 1dbbH-1um1A:
20.00
1dbbL-1um1A:
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.
1z45 GAL10 BIFUNCTIONAL
PROTEIN

(Saccharomyces
cerevisiae) 		PF01263
(Aldose_epim)
PF16363
(GDP_Man_Dehyd) 		4 ASN A 536
GLY A 424
TYR A 539
VAL A 637
 None
 0.83A 1dbbH-1z45A:
undetectable
1dbbL-1z45A:
undetectable		 1dbbH-1z45A:
17.60
1dbbL-1z45A:
15.64
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.
1zn6 PHAGE-RELATED
CONSERVED
HYPOTHETICAL PROTEIN

(Bordetella
bronchiseptica) 		PF02586
(SRAP) 		4 GLY A  63
TRP A  62
HIS A 173
VAL A 182
 None
None
SO4  A 302 (-4.2A)
None
 0.89A 1dbbH-1zn6A:
undetectable
1dbbL-1zn6A:
undetectable		 1dbbH-1zn6A:
20.41
1dbbL-1zn6A:
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.
2aeh FOCAL ADHESION
KINASE 1

(Gallus gallus) 		PF00373
(FERM_M) 		4 GLY A 275
GLY A 279
TYR A 347
VAL A 329
 None
 0.91A 1dbbH-2aehA:
undetectable
1dbbL-2aehA:
undetectable		 1dbbH-2aehA:
20.55
1dbbL-2aehA:
19.36
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.
2b2x INTEGRIN ALPHA-1

(Rattus
norvegicus) 		PF00092
(VWA) 		4 GLY A 221
GLY A 220
HIS A 196
VAL A 152
 None
 0.91A 1dbbH-2b2xA:
undetectable
1dbbL-2b2xA:
undetectable		 1dbbH-2b2xA:
17.99
1dbbL-2b2xA:
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.
2dmb FILAMIN-B

(Homo sapiens) 		PF00630
(Filamin) 		4 GLY A  20
GLY A  32
TYR A  73
VAL A  45
 None
 0.83A 1dbbH-2dmbA:
5.4
1dbbL-2dmbA:
3.9		 1dbbH-2dmbA:
19.91
1dbbL-2dmbA:
20.00
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.
2eea FILAMIN-B

(Homo sapiens) 		PF00630
(Filamin) 		4 GLY A  50
ASN A  95
GLY A  52
VAL A  92
 None
 0.91A 1dbbH-2eeaA:
5.5
1dbbL-2eeaA:
4.7		 1dbbH-2eeaA:
22.06
1dbbL-2eeaA:
24.34
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.
2ewm (S)-1-PHENYLETHANOL
DEHYDROGENASE

(Azoarcus) 		PF13561
(adh_short_C2) 		4 GLY A  15
ASN A  89
GLY A  14
VAL A 187
 None
NAD  A 257 (-3.8A)
NAD  A 257 (-3.3A)
NAD  A 257 (-4.1A)
 0.92A 1dbbH-2ewmA:
undetectable
1dbbL-2ewmA:
undetectable		 1dbbH-2ewmA:
23.33
1dbbL-2ewmA:
20.87
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.
2f5v PYRANOSE 2-OXIDASE

(Peniophora sp.
SG) 		PF05199
(GMC_oxred_C) 		4 GLY A 584
GLY A 582
HIS A 167
VAL A 157
 None
FAD  A1625 ( 3.9A)
FAD  A1625 (-2.8A)
None
 0.91A 1dbbH-2f5vA:
undetectable
1dbbL-2f5vA:
undetectable		 1dbbH-2f5vA:
15.62
1dbbL-2f5vA:
18.02
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.
2ffi 2-PYRONE-4,6-DICARBO
XYLIC ACID
HYDROLASE, PUTATIVE

(Pseudomonas
putida) 		PF04909
(Amidohydro_2) 		4 GLY A 190
GLY A 192
TYR A 226
VAL A 140
 None
 0.81A 1dbbH-2ffiA:
undetectable
1dbbL-2ffiA:
undetectable		 1dbbH-2ffiA:
19.45
1dbbL-2ffiA:
21.11
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.
2igt SAM DEPENDENT
METHYLTRANSFERASE

(Agrobacterium
fabrum) 		PF10672
(Methyltrans_SAM) 		4 GLY A 144
ASN A 138
GLY A 141
VAL A 249
 None
 0.83A 1dbbH-2igtA:
undetectable
1dbbL-2igtA:
undetectable		 1dbbH-2igtA:
22.84
1dbbL-2igtA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ja9 EXOSOME COMPLEX
EXONUCLEASE RRP40

(Saccharomyces
cerevisiae) 		PF15985
(KH_6) 		4 GLY A 189
ASN A 191
TYR A 120
VAL A  95
 None
 0.90A 1dbbH-2ja9A:
undetectable
1dbbL-2ja9A:
undetectable		 1dbbH-2ja9A:
19.82
1dbbL-2ja9A:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o4c ERYTHRONATE-4-PHOSPH
ATE DEHYDROGENASE

(Pseudomonas
aeruginosa) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C)
PF11890
(DUF3410) 		4 GLY A 139
TRP A 140
HIS A 174
VAL A 170
 None
 0.91A 1dbbH-2o4cA:
undetectable
1dbbL-2o4cA:
undetectable		 1dbbH-2o4cA:
20.99
1dbbL-2o4cA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2paa PHOSPHOGLYCERATE
KINASE, TESTIS
SPECIFIC

(Mus musculus) 		PF00162
(PGK) 		4 GLY A 337
TRP A 335
GLY A 212
VAL A 327
 ATP  A 500 (-3.1A)
None
None
None
 0.83A 1dbbH-2paaA:
undetectable
1dbbL-2paaA:
undetectable		 1dbbH-2paaA:
18.84
1dbbL-2paaA:
19.32
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.
2qq6 MANDELATE
RACEMASE/MUCONATE
LACTONIZING
ENZYME-LIKE PROTEIN

(Rubrobacter
xylanophilus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A 294
GLY A 295
TYR A  68
VAL A  23
 None
 0.87A 1dbbH-2qq6A:
undetectable
1dbbL-2qq6A:
undetectable		 1dbbH-2qq6A:
20.20
1dbbL-2qq6A:
18.20
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.
2vxo GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Homo sapiens) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 GLY A 102
GLY A 106
HIS A 119
VAL A 160
 None
 0.90A 1dbbH-2vxoA:
undetectable
1dbbL-2vxoA:
undetectable		 1dbbH-2vxoA:
14.57
1dbbL-2vxoA:
14.58
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.
2w2k D-MANDELATE
DEHYDROGENASE

(Rhodotorula
graminis) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		4 GLY B 258
ASN B 254
TYR B 230
VAL B 169
 None
 0.84A 1dbbH-2w2kB:
undetectable
1dbbL-2w2kB:
undetectable		 1dbbH-2w2kB:
20.49
1dbbL-2w2kB:
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.
2w5o ALPHA-L-ARABINOFURAN
OSIDASE

(Fusarium
graminearum) 		no annotation 4 GLY A 246
TRP A 256
GLY A 244
TYR A 260
 None
 0.89A 1dbbH-2w5oA:
undetectable
1dbbL-2w5oA:
undetectable		 1dbbH-2w5oA:
20.37
1dbbL-2w5oA:
20.33
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.
2xfg ENDOGLUCANASE 1

(Ruminiclostridium
thermocellum) 		PF00759
(Glyco_hydro_9)
PF00942
(CBM_3) 		4 GLY B 557
GLY B 556
TRP A 129
HIS A 376
 None
 0.78A 1dbbH-2xfgB:
2.1
1dbbL-2xfgB:
undetectable		 1dbbH-2xfgB:
23.56
1dbbL-2xfgB:
20.36
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.
2zzr UNSATURATED
GLUCURONYL HYDROLASE

(Streptococcus
agalactiae) 		PF07470
(Glyco_hydro_88) 		5 GLY A 298
GLY A 300
TYR A 290
TRP A 291
HIS A 367
 SO4  A 402 (-3.5A)
SO4  A 402 (-3.3A)
SO4  A 402 (-4.5A)
None
None
 1.33A 1dbbH-2zzrA:
undetectable
1dbbL-2zzrA:
undetectable		 1dbbH-2zzrA:
20.10
1dbbL-2zzrA:
18.25
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.
3ayx MEMBRANE-BOUND
HYDROGENASE LARGE
SUBUNIT
MEMBRANE-BOUND
HYDROGENASE SMALL
SUBUNIT

(Hydrogenovibrio
marinus) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		4 GLY B  20
GLY B  83
HIS A  83
VAL A  78
 None
None
CMO  A 603 (-4.0A)
O  A 609 ( 4.7A)
 0.93A 1dbbH-3ayxB:
undetectable
1dbbL-3ayxB:
undetectable		 1dbbH-3ayxB:
18.56
1dbbL-3ayxB:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b0p TRNA-DIHYDROURIDINE
SYNTHASE

(Thermus
thermophilus) 		PF01207
(Dus) 		4 GLY A 104
ASN A  90
GLY A  92
VAL A  12
 None
FMN  A 351 (-4.0A)
None
FMN  A 351 (-4.0A)
 0.73A 1dbbH-3b0pA:
undetectable
1dbbL-3b0pA:
undetectable		 1dbbH-3b0pA:
22.22
1dbbL-3b0pA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		4 ASN A 203
GLY A 205
TYR A 246
VAL A 119
 None
 0.84A 1dbbH-3bo5A:
undetectable
1dbbL-3bo5A:
undetectable		 1dbbH-3bo5A:
18.66
1dbbL-3bo5A:
22.37
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.
3brz TODX

(Pseudomonas
putida) 		PF03349
(Toluene_X) 		4 GLY A 152
ASN A  33
GLY A 224
VAL A 234
 None
 0.75A 1dbbH-3brzA:
undetectable
1dbbL-3brzA:
undetectable		 1dbbH-3brzA:
20.63
1dbbL-3brzA:
23.72
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.
3cjt RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE

(Thermus
thermophilus) 		PF06325
(PrmA) 		4 GLY A 102
GLY A 100
HIS A 197
VAL A 189
 None
SAH  A 258 (-3.1A)
None
None
 0.86A 1dbbH-3cjtA:
undetectable
1dbbL-3cjtA:
undetectable		 1dbbH-3cjtA:
19.85
1dbbL-3cjtA:
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.
3e9y ACETOLACTATE
SYNTHASE,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 GLY A 353
ASN A 358
GLY A 350
VAL A 303
 None
None
FAB  A 701 ( 3.8A)
None
 0.89A 1dbbH-3e9yA:
undetectable
1dbbL-3e9yA:
undetectable		 1dbbH-3e9yA:
17.15
1dbbL-3e9yA:
17.77
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.
3ecq ENDO-ALPHA-N-ACETYLG
ALACTOSAMINIDASE

(Streptococcus
pneumoniae) 		PF12905
(Glyco_hydro_101)
PF17451
(Glyco_hyd_101C) 		4 GLY A 772
ASN A 774
GLY A 769
VAL A 763
 None
 0.89A 1dbbH-3ecqA:
undetectable
1dbbL-3ecqA:
2.3		 1dbbH-3ecqA:
9.83
1dbbL-3ecqA:
9.20
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.
3eez PUTATIVE MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME

(Ruegeria
pomeroyi) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A  64
GLY A  62
TYR A 100
VAL A  36
 None
 0.84A 1dbbH-3eezA:
undetectable
1dbbL-3eezA:
undetectable		 1dbbH-3eezA:
18.62
1dbbL-3eezA:
19.26
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.
3hcz POSSIBLE
THIOL-DISULFIDE
ISOMERASE

(Cytophaga
hutchinsonii) 		PF00578
(AhpC-TSA) 		4 GLY A 416
ASN A 419
TRP A 417
GLY A 415
 None
 0.92A 1dbbH-3hczA:
undetectable
1dbbL-3hczA:
undetectable		 1dbbH-3hczA:
17.41
1dbbL-3hczA:
19.91
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.
3hdx SUSD SUPERFAMILY
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 GLY A 489
ASN A 508
GLY A 488
VAL A 166
 None
 0.92A 1dbbH-3hdxA:
undetectable
1dbbL-3hdxA:
undetectable		 1dbbH-3hdxA:
17.26
1dbbL-3hdxA:
19.04
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.
3ib3 COCE/NOND FAMILY
HYDROLASE

(Staphylococcus
aureus) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 GLY A 194
ASN A 196
TRP A 176
GLY A 277
 None
 0.91A 1dbbH-3ib3A:
undetectable
1dbbL-3ib3A:
undetectable		 1dbbH-3ib3A:
17.17
1dbbL-3ib3A:
18.66
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.
3ifc FRUCTOSE-1,6-BISPHOS
PHATASE ISOZYME 2

(Homo sapiens) 		PF00316
(FBPase) 		4 GLY A 178
GLY A 180
TYR A 286
VAL A 173
 None
 0.87A 1dbbH-3ifcA:
undetectable
1dbbL-3ifcA:
undetectable		 1dbbH-3ifcA:
22.54
1dbbL-3ifcA:
22.19
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.
3j4u MAJOR CAPSID PROTEIN

(Bordetella
virus BPP1) 		no annotation 4 GLY A 270
GLY A 272
TYR A 233
HIS A  53
 None
 0.86A 1dbbH-3j4uA:
undetectable
1dbbL-3j4uA:
undetectable		 1dbbH-3j4uA:
22.29
1dbbL-3j4uA:
23.53
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.
3jvd TRANSCRIPTIONAL
REGULATORS

(Corynebacterium
glutamicum) 		PF13377
(Peripla_BP_3) 		4 GLY A 182
GLY A 212
TYR A 214
VAL A 246
 None
 0.93A 1dbbH-3jvdA:
undetectable
1dbbL-3jvdA:
undetectable		 1dbbH-3jvdA:
21.16
1dbbL-3jvdA:
19.53
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.
3k2k PUTATIVE
CARBOXYPEPTIDASE

(Burkholderia
mallei) 		PF00246
(Peptidase_M14) 		4 GLY A 223
TRP A  40
GLY A  12
VAL A  75
 None
 0.86A 1dbbH-3k2kA:
undetectable
1dbbL-3k2kA:
undetectable		 1dbbH-3k2kA:
18.00
1dbbL-3k2kA:
18.92
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.
3lb9 ENDO-1,4-BETA-XYLANA
SE

(Bacillus
circulans) 		PF00457
(Glyco_hydro_11) 		4 GLY A  78
GLY A  99
TRP A  95
VAL A 103
 None
 0.92A 1dbbH-3lb9A:
undetectable
1dbbL-3lb9A:
1.3		 1dbbH-3lb9A:
25.65
1dbbL-3lb9A:
21.68
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.
3mqt MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A 287
GLY A 288
TYR A  82
VAL A  10
 None
 0.88A 1dbbH-3mqtA:
undetectable
1dbbL-3mqtA:
undetectable		 1dbbH-3mqtA:
18.91
1dbbL-3mqtA:
17.12
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.
3mqt MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLY A 287
GLY A 288
TYR A  82
VAL A  31
 None
 0.91A 1dbbH-3mqtA:
undetectable
1dbbL-3mqtA:
undetectable		 1dbbH-3mqtA:
18.91
1dbbL-3mqtA:
17.12
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.
3n5f N-CARBAMOYL-L-AMINO
ACID HYDROLASE

(Geobacillus
stearothermophilus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 ASN A  59
GLY A 135
HIS A 189
VAL A  95
 None
None
CO  A 410 (-3.5A)
None
 0.92A 1dbbH-3n5fA:
undetectable
1dbbL-3n5fA:
undetectable		 1dbbH-3n5fA:
21.62
1dbbL-3n5fA:
17.92
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.
3nre ALDOSE 1-EPIMERASE

(Escherichia
coli) 		PF01263
(Aldose_epim) 		4 GLY A  19
GLY A  20
TRP A 147
VAL A 133
 None
 0.86A 1dbbH-3nreA:
undetectable
1dbbL-3nreA:
undetectable		 1dbbH-3nreA:
21.81
1dbbL-3nreA:
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.
3nvq SEMAPHORIN-7A

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI)
PF13895
(Ig_2) 		4 GLY A  91
GLY A  90
TYR A  96
VAL A 160
 None
 0.70A 1dbbH-3nvqA:
undetectable
1dbbL-3nvqA:
undetectable		 1dbbH-3nvqA:
16.75
1dbbL-3nvqA:
16.19
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.
3oth CALG1

(Micromonospora
echinospora) 		PF00201
(UDPGT)
PF03033
(Glyco_transf_28) 		4 GLY A 124
ASN A 120
GLY A 122
VAL A  51
 None
 0.93A 1dbbH-3othA:
undetectable
1dbbL-3othA:
undetectable		 1dbbH-3othA:
20.98
1dbbL-3othA:
17.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p1w RABGDI PROTEIN

(Plasmodium
falciparum) 		PF00996
(GDI) 		4 GLY A  13
GLY A  41
TYR A 417
VAL A 297
 None
 0.79A 1dbbH-3p1wA:
undetectable
1dbbL-3p1wA:
undetectable		 1dbbH-3p1wA:
19.46
1dbbL-3p1wA:
18.09
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.
3p4s FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT

(Escherichia
coli) 		PF00890
(FAD_binding_2)
PF02910
(Succ_DH_flav_C) 		4 GLY A  16
GLY A  13
HIS A 510
VAL A 157
 None
FAD  A 601 (-3.2A)
None
FAD  A 601 (-4.1A)
 0.88A 1dbbH-3p4sA:
undetectable
1dbbL-3p4sA:
undetectable		 1dbbH-3p4sA:
16.72
1dbbL-3p4sA:
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.
3qjp PUTATIVE
UNCHARACTERIZED
PROTEIN PH0350

(Pyrococcus
horikoshii) 		PF01881
(Cas_Cas6) 		4 GLY A 229
GLY A 231
TYR A  25
VAL A   5
 None
 0.89A 1dbbH-3qjpA:
undetectable
1dbbL-3qjpA:
undetectable		 1dbbH-3qjpA:
17.39
1dbbL-3qjpA:
20.16
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.
3r7t ADENYLOSUCCINATE
SYNTHETASE

(Campylobacter
jejuni) 		PF00709
(Adenylsucc_synt) 		4 GLY A  36
GLY A  37
TYR A 134
HIS A 106
 None
 0.83A 1dbbH-3r7tA:
undetectable
1dbbL-3r7tA:
undetectable		 1dbbH-3r7tA:
18.76
1dbbL-3r7tA:
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.
3s69 THROMBIN-LIKE ENZYME
DEFIBRASE

(Gloydius
saxatilis) 		PF00089
(Trypsin) 		4 GLY A 193
GLY A 139
TYR A 148
VAL A  68
 None
 0.93A 1dbbH-3s69A:
undetectable
1dbbL-3s69A:
undetectable		 1dbbH-3s69A:
20.63
1dbbL-3s69A:
22.36
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.
3s7v MAJOR CAPSID PROTEIN
VP1

(Human
polyomavirus 3) 		PF00718
(Polyoma_coat) 		4 GLY A 166
GLY A 165
TYR A 271
VAL A  50
 None
 0.89A 1dbbH-3s7vA:
undetectable
1dbbL-3s7vA:
undetectable		 1dbbH-3s7vA:
22.03
1dbbL-3s7vA:
19.49
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.
3uk1 TRANSKETOLASE

(Burkholderia
thailandensis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLY A 653
GLY A 654
TRP A 645
VAL A 608
 None
 0.77A 1dbbH-3uk1A:
undetectable
1dbbL-3uk1A:
undetectable		 1dbbH-3uk1A:
16.54
1dbbL-3uk1A:
14.03
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.
3v8v RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L

(Escherichia
coli) 		PF01170
(UPF0020)
PF02926
(THUMP)
PF10672
(Methyltrans_SAM) 		5 ASN A 580
TRP A 576
GLY A 550
TYR A 548
VAL A 503
 None
None
None
SAM  A 802 (-4.7A)
None
 1.35A 1dbbH-3v8vA:
undetectable
1dbbL-3v8vA:
undetectable		 1dbbH-3v8vA:
14.06
1dbbL-3v8vA:
16.21
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.
3vpx LEUCINE
DEHYDROGENASE

(Sporosarcina
psychrophila) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		4 GLY A  78
ASN A  69
GLY A  77
VAL A 294
 None
 0.90A 1dbbH-3vpxA:
undetectable
1dbbL-3vpxA:
undetectable		 1dbbH-3vpxA:
20.97
1dbbL-3vpxA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wq8 BETA-GLUCOSIDASE

(Pyrococcus
furiosus) 		PF00232
(Glyco_hydro_1) 		4 GLY A  79
GLY A  78
TYR A 134
VAL A 259
 None
 0.85A 1dbbH-3wq8A:
undetectable
1dbbL-3wq8A:
undetectable		 1dbbH-3wq8A:
18.97
1dbbL-3wq8A:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zuk ENDOPEPTIDASE,
PEPTIDASE FAMILY M13

(Mycobacterium
tuberculosis) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		4 GLY A 131
GLY A 155
TRP A 289
HIS A 179
 None
 0.78A 1dbbH-3zukA:
undetectable
1dbbL-3zukA:
undetectable		 1dbbH-3zukA:
13.99
1dbbL-3zukA:
13.12
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.
4amf PHOX

(Pseudomonas
fluorescens) 		PF05787
(DUF839) 		4 GLY A 174
GLY A 145
HIS A  43
VAL A 121
 None
 0.69A 1dbbH-4amfA:
undetectable
1dbbL-4amfA:
undetectable		 1dbbH-4amfA:
15.95
1dbbL-4amfA:
16.84
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.
4amf PHOX

(Pseudomonas
fluorescens) 		PF05787
(DUF839) 		4 GLY A 464
GLY A 465
TYR A 426
VAL A 415
 None
 0.89A 1dbbH-4amfA:
undetectable
1dbbL-4amfA:
undetectable		 1dbbH-4amfA:
15.95
1dbbL-4amfA:
16.84
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.
4b6z FAMILY M14
UNASSIGNED PEPTIDASE

(Burkholderia
cenocepacia) 		PF00246
(Peptidase_M14) 		4 GLY A 223
TRP A  40
GLY A  12
VAL A  75
 None
None
GOL  A1386 (-4.7A)
None
 0.88A 1dbbH-4b6zA:
undetectable
1dbbL-4b6zA:
undetectable		 1dbbH-4b6zA:
20.41
1dbbL-4b6zA:
18.02
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.
4bvl PHB DEPOLYMERASE
PHAZ7

(Paucimonas
lemoignei) 		PF01674
(Lipase_2) 		4 GLY A  29
GLY A  30
HIS A 135
VAL A  10
 None
 0.83A 1dbbH-4bvlA:
undetectable
1dbbL-4bvlA:
undetectable		 1dbbH-4bvlA:
21.76
1dbbL-4bvlA:
21.41
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.
4ccl 50S RIBOSOMAL
PROTEIN L16 ARGININE
HYDROXYLASE

(Escherichia
coli) 		PF08007
(Cupin_4) 		4 GLY A 307
ASN A  87
GLY A 308
VAL A  83
 None
 0.82A 1dbbH-4cclA:
undetectable
1dbbL-4cclA:
undetectable		 1dbbH-4cclA:
18.67
1dbbL-4cclA:
19.35
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.
4d5g CYCLOHEXANE-1,2-DION
E HYDROLASE

(Azoarcus sp.
BH72) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		4 GLY A 261
ASN A 266
GLY A 258
VAL A 209
 FAD  A1588 (-3.8A)
None
FAD  A1588 (-3.2A)
None
 0.92A 1dbbH-4d5gA:
undetectable
1dbbL-4d5gA:
undetectable		 1dbbH-4d5gA:
17.15
1dbbL-4d5gA:
14.89
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.
4ddd IMMUNOGENIC PROTEIN

(Ehrlichia
chaffeensis) 		PF16868
(NMT1_3) 		4 GLY A 168
TRP A 169
GLY A 165
VAL A 147
 None
 0.91A 1dbbH-4dddA:
undetectable
1dbbL-4dddA:
undetectable		 1dbbH-4dddA:
21.30
1dbbL-4dddA:
21.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4djh KAPPA-TYPE OPIOID
RECEPTOR, LYSOZYME

(Escherichia
virus T4;
Homo sapiens) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		4 GLY A  76
ASN A  77
GLY A  73
VAL A 279
 None
 0.89A 1dbbH-4djhA:
undetectable
1dbbL-4djhA:
undetectable		 1dbbH-4djhA:
16.98
1dbbL-4djhA:
19.44
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.
4dkn AMPHIOXUS GREEN
FLUORESCENT PROTEIN,
GFPA1

(Branchiostoma
floridae) 		PF01353
(GFP) 		4 GLY A  25
GLY A  26
TYR A  61
VAL A 199
 None
None
CR2  A  60 ( 3.5A)
None
 0.91A 1dbbH-4dknA:
undetectable
1dbbL-4dknA:
undetectable		 1dbbH-4dknA:
20.58
1dbbL-4dknA:
24.62
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.
4e8u PUTATIVE
UNCHARACTERIZED
PROTEIN T8P19.180

(Arabidopsis
thaliana) 		PF03468
(XS) 		4 GLY A 236
ASN A 238
GLY A 241
VAL A 136
 None
 0.85A 1dbbH-4e8uA:
undetectable
1dbbL-4e8uA:
undetectable		 1dbbH-4e8uA:
20.70
1dbbL-4e8uA:
17.89
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.
4fxd DNA POLYMERASE ALPHA
CATALYTIC SUBUNIT A

(Saccharomyces
cerevisiae) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 GLY A 791
ASN A 701
GLY A 790
TRP A 785
 None
 0.91A 1dbbH-4fxdA:
undetectable
1dbbL-4fxdA:
undetectable		 1dbbH-4fxdA:
13.42
1dbbL-4fxdA:
13.18
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.
4gvx 3-OXOACYL-[ACYL-CARR
IER PROTEIN]
REDUCTASE

(Burkholderia
multivorans) 		PF13561
(adh_short_C2) 		4 GLY A  15
ASN A  90
GLY A  14
VAL A 186
 None
NAP  A 301 (-3.4A)
NAP  A 301 (-3.2A)
NAP  A 301 (-3.8A)
 0.92A 1dbbH-4gvxA:
undetectable
1dbbL-4gvxA:
undetectable		 1dbbH-4gvxA:
22.51
1dbbL-4gvxA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4h7n ALDEHYDE
DEHYDROGENASE

(Trichormus
variabilis) 		PF00171
(Aldedh) 		4 GLY A 338
GLY A 340
TYR A 294
VAL A  72
 None
 0.85A 1dbbH-4h7nA:
undetectable
1dbbL-4h7nA:
undetectable		 1dbbH-4h7nA:
18.70
1dbbL-4h7nA:
16.42
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.
4hz5 DNA TOPOISOMERASE
IV, B SUBUNIT

(Enterococcus
faecalis) 		PF02518
(HATPase_c) 		5 GLY A 151
ASN A 126
GLY A 150
TRP A 131
VAL A 171
 None
None
None
None
19Y  A 301 ( 4.6A)
 1.44A 1dbbH-4hz5A:
undetectable
1dbbL-4hz5A:
undetectable		 1dbbH-4hz5A:
21.25
1dbbL-4hz5A:
23.46
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.
4ieg RNA-DEPENDENT RNA
POLYMERASE P2

(Pseudomonas
phage phi12) 		no annotation 5 ASN A 466
TRP A 329
GLY A 468
TRP A 432
VAL A 438
 None
 1.23A 1dbbH-4iegA:
undetectable
1dbbL-4iegA:
undetectable		 1dbbH-4iegA:
16.23
1dbbL-4iegA:
15.74
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.
4igl YENB

(Yersinia
entomophaga) 		PF03534
(SpvB)
PF12255
(TcdB_toxin_midC)
PF12256
(TcdB_toxin_midN) 		4 GLY A 716
ASN A 713
GLY A1360
VAL A  28
 None
 0.70A 1dbbH-4iglA:
undetectable
1dbbL-4iglA:
undetectable		 1dbbH-4iglA:
9.65
1dbbL-4iglA:
9.77
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.
4itu SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Xanthobacter
autotrophicus) 		PF13561
(adh_short_C2) 		4 GLY A  15
ASN A  91
GLY A  14
VAL A 189
 None
NAI  A 301 (-3.4A)
NAI  A 301 (-3.3A)
NAI  A 301 (-4.0A)
 0.87A 1dbbH-4ituA:
undetectable
1dbbL-4ituA:
undetectable		 1dbbH-4ituA:
20.51
1dbbL-4ituA:
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.
4r0y MALTOSE-BINDING
PERIPLASMIC PROTEIN,
DISKS
LARGE-ASSOCIATED
PROTEIN 1

(Escherichia
coli;
Rattus
norvegicus) 		PF03359
(GKAP)
PF13416
(SBP_bac_8) 		4 GLY A 165
ASN A 185
GLY A 166
VAL A 357
 None
 0.85A 1dbbH-4r0yA:
undetectable
1dbbL-4r0yA:
undetectable		 1dbbH-4r0yA:
19.42
1dbbL-4r0yA:
16.97
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.
4r1d UNCHARACTERIZED
PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 4 GLY A 137
ASN A  61
GLY A 117
VAL A 304
 None
 0.87A 1dbbH-4r1dA:
undetectable
1dbbL-4r1dA:
undetectable		 1dbbH-4r1dA:
17.02
1dbbL-4r1dA:
15.58
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.
4ru5 TAILSPIKE GP27

(Pseudomonas
phage phi297) 		no annotation 4 GLY A 441
ASN A 450
GLY A 440
VAL A 395
 None
 0.93A 1dbbH-4ru5A:
undetectable
1dbbL-4ru5A:
2.3		 1dbbH-4ru5A:
16.56
1dbbL-4ru5A:
16.28
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.
4rwa SOLUBLE CYTOCHROME
B562,DELTA-TYPE
OPIOID RECEPTOR

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		4 GLY A  66
ASN A  67
GLY A  63
VAL A 266
 None
 0.88A 1dbbH-4rwaA:
undetectable
1dbbL-4rwaA:
undetectable		 1dbbH-4rwaA:
18.56
1dbbL-4rwaA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4s3j CORTICAL-LYTIC
ENZYME

(Bacillus cereus) 		PF00704
(Glyco_hydro_18)
PF01476
(LysM) 		4 GLY A 290
TRP A 328
GLY A 289
VAL A 342
 None
 0.87A 1dbbH-4s3jA:
undetectable
1dbbL-4s3jA:
undetectable		 1dbbH-4s3jA:
21.51
1dbbL-4s3jA:
16.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4tnb G PROTEIN-COUPLED
RECEPTOR KINASE 5

(Homo sapiens) 		PF00069
(Pkinase)
PF00615
(RGS) 		4 GLY A  21
GLY A  20
HIS A 324
VAL A 466
 None
 0.91A 1dbbH-4tnbA:
undetectable
1dbbL-4tnbA:
undetectable		 1dbbH-4tnbA:
17.46
1dbbL-4tnbA:
17.19
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.
4ut7 BROADLY NEUTRALIZING
HUMAN ANTIBODY EDE2
A11

(Homo sapiens) 		PF07686
(V-set) 		4 GLY L 100
GLY L  99
TYR L  87
VAL H  48
 None
 0.92A 1dbbH-4ut7L:
15.5
1dbbL-4ut7L:
16.9		 1dbbH-4ut7L:
26.85
1dbbL-4ut7L:
29.28
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.
4v0n BARDET-BIEDL
SYNDROME 1 PROTEIN

(Chlamydomonas
reinhardtii) 		PF14779
(BBS1) 		5 GLY B  67
ASN B  62
GLY B  65
HIS B  92
VAL B  72
 None
 1.44A 1dbbH-4v0nB:
undetectable
1dbbL-4v0nB:
undetectable		 1dbbH-4v0nB:
19.10
1dbbL-4v0nB:
18.29