SIMILAR PATTERNS OF AMINO ACIDS FOR 2AB2_B_SNLB503

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.
1bqc PROTEIN
(BETA-MANNANASE)

(Thermobifida
fusca) 		PF00150
(Cellulase) 		5 LEU A  79
ASN A  47
ALA A 295
MET A 268
PHE A  19
 None
 1.48A 2ab2B-1bqcA:
undetectable		 2ab2B-1bqcA:
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.
1t3q QUINOLINE
2-OXIDOREDUCTASE
MEDIUM SUBUNIT

(Pseudomonas
putida) 		PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C) 		5 LEU C 115
ALA C 220
GLN C 222
ARG C 210
MET C 135
 None
 1.43A 2ab2B-1t3qC:
undetectable		 2ab2B-1t3qC:
22.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ax9 ANDROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 LEU A 701
ASN A 705
GLN A 711
MET A 742
ARG A 752
PHE A 764
MET A 780
MET A 787
PHE A 891
 None
BHM  A   1 (-3.6A)
BHM  A   1 (-2.2A)
BHM  A   1 ( 4.0A)
BHM  A   1 (-3.8A)
BHM  A   1 (-4.4A)
BHM  A   1 ( 4.3A)
BHM  A   1 (-3.6A)
None
 0.71A 2ab2B-2ax9A:
35.7		 2ab2B-2ax9A:
48.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		5 ASN A  33
PHE A  98
CYH A 205
THR A 208
PHE A 219
 1CA  A 247 (-2.9A)
None
1CA  A 247 (-4.0A)
1CA  A 247 (-3.4A)
1CA  A 247 (-4.5A)
 1.16A 2ab2B-2q3yA:
38.4		 2ab2B-2q3yA:
68.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		5 LEU A  28
GLN A  39
ARG A  80
PHE A  92
MET A 115
 None
1CA  A 247 (-3.1A)
1CA  A 247 (-3.8A)
None
1CA  A 247 ( 3.7A)
 1.48A 2ab2B-2q3yA:
38.4		 2ab2B-2q3yA:
68.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		12 LEU A  29
ASN A  33
ALA A  36
GLN A  39
MET A  70
ARG A  80
PHE A  92
MET A 108
MET A 115
CYH A 205
THR A 208
PHE A 219
 1CA  A 247 ( 3.6A)
1CA  A 247 (-2.9A)
1CA  A 247 (-3.6A)
1CA  A 247 (-3.1A)
1CA  A 247 ( 3.8A)
1CA  A 247 (-3.8A)
None
1CA  A 247 (-3.9A)
1CA  A 247 ( 3.7A)
1CA  A 247 (-4.0A)
1CA  A 247 (-3.4A)
1CA  A 247 (-4.5A)
 0.39A 2ab2B-2q3yA:
38.4		 2ab2B-2q3yA:
68.73
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.
3a9s D-ARABINOSE
ISOMERASE

(Aeribacillus
pallidus) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		5 ALA A 361
GLN A 362
MET A 460
CYH A 431
THR A 435
 None
 1.38A 2ab2B-3a9sA:
undetectable		 2ab2B-3a9sA:
17.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 GLN A 725
MET A 756
ARG A 766
MET A 801
CYH A 891
THR A 894
PHE A 905
 WOW  A   1 ( 4.1A)
WOW  A   1 ( 4.1A)
WOW  A   1 (-3.8A)
WOW  A   1 (-4.2A)
WOW  A   1 (-3.5A)
WOW  A   1 (-3.9A)
WOW  A   1 (-4.6A)
 0.87A 2ab2B-3kbaA:
35.3		 2ab2B-3kbaA:
52.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		9 LEU A 715
ASN A 719
MET A 756
ARG A 766
PHE A 778
MET A 801
CYH A 891
THR A 894
PHE A 905
 WOW  A   1 (-3.9A)
WOW  A   1 (-3.3A)
WOW  A   1 ( 4.1A)
WOW  A   1 (-3.8A)
None
WOW  A   1 (-4.2A)
WOW  A   1 (-3.5A)
WOW  A   1 (-3.9A)
WOW  A   1 (-4.6A)
 0.59A 2ab2B-3kbaA:
35.3		 2ab2B-3kbaA:
52.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ry9 ANCESTRAL
GLUCOCORTICOID
RECEPTOR 1

(synthetic
construct) 		PF00104
(Hormone_recep) 		11 LEU A  29
ASN A  33
GLN A  39
MET A  70
ARG A  80
PHE A  92
MET A 108
MET A 115
CYH A 205
THR A 208
PHE A 219
 1CA  A 249 ( 3.8A)
1CA  A 249 (-3.0A)
1CA  A 249 (-3.0A)
1CA  A 249 ( 3.8A)
1CA  A 249 (-3.5A)
None
1CA  A 249 (-3.6A)
1CA  A 249 (-3.6A)
1CA  A 249 (-4.0A)
1CA  A 249 (-3.2A)
1CA  A 249 (-4.3A)
 0.35A 2ab2B-3ry9A:
37.6		 2ab2B-3ry9A:
65.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ry9 ANCESTRAL
GLUCOCORTICOID
RECEPTOR 1

(synthetic
construct) 		PF00104
(Hormone_recep) 		6 LEU A  29
PHE A  98
MET A 108
CYH A 205
THR A 208
PHE A 219
 1CA  A 249 ( 3.8A)
None
1CA  A 249 (-3.6A)
1CA  A 249 (-4.0A)
1CA  A 249 (-3.2A)
1CA  A 249 (-4.3A)
 1.42A 2ab2B-3ry9A:
37.6		 2ab2B-3ry9A:
65.93
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.
4iqg SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Polaromonas sp.
JS666) 		no annotation 5 LEU C  68
ALA C  59
GLN C  58
CYH C 119
PHE C  71
 None
 1.40A 2ab2B-4iqgC:
undetectable		 2ab2B-4iqgC:
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.
4n1y ESTROGEN RECEPTOR

(Crassostrea
gigas) 		PF00104
(Hormone_recep) 		7 LEU A 280
ALA A 287
MET A 321
ARG A 331
PHE A 342
MET A 358
PHE A 462
 None
 0.67A 2ab2B-4n1yA:
28.1		 2ab2B-4n1yA:
28.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p6w GLUCOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		8 ASN A 564
GLN A 570
MET A 601
ARG A 611
PHE A 623
CYH A 736
THR A 739
PHE A 749
 MOF  A 801 (-3.0A)
MOF  A 801 (-2.9A)
MOF  A 801 (-3.7A)
MOF  A 801 (-4.2A)
MOF  A 801 (-4.7A)
MOF  A 801 (-3.7A)
MOF  A 801 (-3.9A)
MOF  A 801 (-4.4A)
 0.32A 2ab2B-4p6wA:
34.5		 2ab2B-4p6wA:
56.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p6w GLUCOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 ASN A 564
GLN A 570
MET A 601
ARG A 611
PHE A 623
MET A 646
CYH A 736
 MOF  A 801 (-3.0A)
MOF  A 801 (-2.9A)
MOF  A 801 (-3.7A)
MOF  A 801 (-4.2A)
MOF  A 801 (-4.7A)
MOF  A 801 (-4.4A)
MOF  A 801 (-3.7A)
 0.75A 2ab2B-4p6wA:
34.5		 2ab2B-4p6wA:
56.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		11 LEU A 766
ASN A 770
ALA A 773
GLN A 776
MET A 807
ARG A 817
PHE A 829
MET A 852
CYH A 942
THR A 945
PHE A 956
 CV7  A1987 (-3.6A)
CV7  A1987 (-3.1A)
CV7  A1987 (-3.5A)
CV7  A1987 (-3.0A)
CV7  A1987 ( 3.9A)
CV7  A1987 (-3.7A)
CV7  A1987 (-4.9A)
CV7  A1987 ( 3.7A)
CV7  A1987 (-4.0A)
CV7  A1987 (-3.1A)
CV7  A1987 ( 4.7A)
 0.36A 2ab2B-4udbA:
36.4		 2ab2B-4udbA:
91.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 9 ASN A 770
ALA A 773
GLN A 776
MET A 807
ARG A 817
PHE A 829
MET A 852
CYH A 942
THR A 945
 ECV  A1101 (-3.1A)
ECV  A1101 (-3.8A)
ECV  A1101 (-2.9A)
ECV  A1101 (-3.6A)
ECV  A1101 (-4.0A)
ECV  A1101 ( 4.9A)
ECV  A1101 (-3.7A)
ECV  A1101 (-4.0A)
ECV  A1101 (-3.2A)
 0.70A 2ab2B-5mwpA:
39.3		 2ab2B-5mwpA:
72.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 11 LEU A 766
ASN A 770
ALA A 773
GLN A 776
MET A 807
ARG A 817
PHE A 829
MET A 845
CYH A 942
THR A 945
PHE A 956
 ECV  A1101 ( 3.9A)
ECV  A1101 (-3.1A)
ECV  A1101 (-3.8A)
ECV  A1101 (-2.9A)
ECV  A1101 (-3.6A)
ECV  A1101 (-4.0A)
ECV  A1101 ( 4.9A)
ECV  A1101 (-4.0A)
ECV  A1101 (-4.0A)
ECV  A1101 (-3.2A)
ECV  A1101 ( 4.7A)
 0.38A 2ab2B-5mwpA:
39.3		 2ab2B-5mwpA:
72.29
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.
5tr1 MONOCLONAL ANTIBODY,
FAB FRAGMENT, LIGHT
CHAIN

(Mus musculus) 		PF07686
(V-set) 		5 LEU L 104
ALA L  74
ARG L  54
PHE L  62
THR L  13
 None
 1.41A 2ab2B-5tr1L:
undetectable		 2ab2B-5tr1L:
17.45
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uc1 GLUCOCORTICOID
RECEPTOR

(Heterocephalus
glaber) 		no annotation 5 ASN A 560
GLN A 566
ARG A 607
PHE A 619
MET A 635
 486  A 801 (-4.2A)
486  A 801 (-2.8A)
486  A 801 (-3.5A)
486  A 801 (-4.7A)
486  A 801 ( 4.7A)
 1.30A 2ab2B-5uc1A:
23.2		 2ab2B-5uc1A:
53.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uc1 GLUCOCORTICOID
RECEPTOR

(Heterocephalus
glaber) 		no annotation 6 ASN A 560
GLN A 566
MET A 597
ARG A 607
PHE A 619
MET A 642
 486  A 801 (-4.2A)
486  A 801 (-2.8A)
CPS  A 803 ( 3.9A)
486  A 801 (-3.5A)
486  A 801 (-4.7A)
486  A 801 ( 3.8A)
 0.85A 2ab2B-5uc1A:
23.2		 2ab2B-5uc1A:
53.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		7 ASN A  33
GLN A  39
ARG A  80
PHE A  92
MET A 108
THR A 208
PHE A 218
 1TA  A 301 (-3.0A)
1TA  A 301 (-3.0A)
1TA  A 301 (-3.5A)
1TA  A 301 (-4.4A)
1TA  A 301 ( 3.0A)
1TA  A 301 (-3.0A)
1TA  A 301 (-4.0A)
 1.09A 2ab2B-5ufsA:
36.5		 2ab2B-5ufsA:
59.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		9 ASN A  33
GLN A  39
MET A  70
ARG A  80
PHE A  92
MET A 115
CYH A 205
THR A 208
PHE A 218
 1TA  A 301 (-3.0A)
1TA  A 301 (-3.0A)
1TA  A 301 ( 3.1A)
1TA  A 301 (-3.5A)
1TA  A 301 (-4.4A)
1TA  A 301 ( 2.8A)
1TA  A 301 (-3.6A)
1TA  A 301 (-3.0A)
1TA  A 301 (-4.0A)
 0.55A 2ab2B-5ufsA:
36.5		 2ab2B-5ufsA:
59.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		5 LEU A  28
GLN A  39
ARG A  80
PHE A  92
MET A 115
 None
1TA  A 301 (-3.0A)
1TA  A 301 (-3.5A)
1TA  A 301 (-4.4A)
1TA  A 301 ( 2.8A)
 1.48A 2ab2B-5ufsA:
36.5		 2ab2B-5ufsA:
59.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ei1 ZINC FINGER WITH
UFM1-SPECIFIC
PEPTIDASE DOMAIN
PROTEIN

(Homo sapiens) 		no annotation 5 LEU A 373
PHE A 365
MET A 385
MET A 396
CYH A 381
 None
 1.46A 2ab2B-6ei1A:
undetectable		 2ab2B-6ei1A:
14.34
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.
6gdt -

(-) 		no annotation 5 LEU A   2
ALA A  18
GLN A  17
PHE A 409
THR A  83
 None
 1.36A 2ab2B-6gdtA:
undetectable		 2ab2B-6gdtA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dgs DNA LIGASE

(Thermus
filiformis) 		PF01653
(DNA_ligase_aden)
PF03120
(DNA_ligase_OB)
PF12826
(HHH_2)
PF14520
(HHH_5) 		4 LEU A 469
LEU A 472
LEU A 492
LEU A 491
 None
 1.01A 2ab2B-1dgsA:
0.0		 2ab2B-1dgsA:
17.25
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.
1iy1 ATP-DEPENDENT
METALLOPROTEASE FTSH

(Thermus
thermophilus) 		PF00004
(AAA) 		4 LEU A 350
LEU A 353
LEU A 365
LEU A 369
 None
 0.85A 2ab2B-1iy1A:
undetectable		 2ab2B-1iy1A:
19.93
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.
1jiw PROTEINASE INHIBITOR

(Pseudomonas
aeruginosa) 		PF02974
(Inh) 		4 LEU I  70
LEU I  50
LEU I  99
LEU I 101
 None
 0.93A 2ab2B-1jiwI:
undetectable		 2ab2B-1jiwI:
18.52
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.
1mxf PTERIDINE REDUCTASE
2

(Trypanosoma
cruzi) 		PF13561
(adh_short_C2) 		4 LEU A  78
LEU A  77
LEU A 143
LEU A 141
 None
 0.99A 2ab2B-1mxfA:
0.0		 2ab2B-1mxfA:
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.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 346
LEU A 349
LEU A 387
LEU A 391
 EST  A   1 (-4.4A)
EST  A   1 ( 4.8A)
EST  A   1 (-4.0A)
EST  A   1 ( 3.9A)
 0.35A 2ab2B-1pcgA:
27.0		 2ab2B-1pcgA:
27.92
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.
1t6p PHENYLALANINE
AMMONIA-LYASE

(Rhodotorula
toruloides) 		PF00221
(Lyase_aromatic) 		4 LEU A 379
LEU A 375
LEU A 427
LEU A 429
 None
 0.99A 2ab2B-1t6pA:
0.0		 2ab2B-1t6pA:
18.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u0m PUTATIVE POLYKETIDE
SYNTHASE

(Streptomyces
coelicolor) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 LEU A 183
LEU A 182
LEU A  39
LEU A  37
 None
 0.95A 2ab2B-1u0mA:
0.0		 2ab2B-1u0mA:
21.27
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.
1u7p MAGNESIUM-DEPENDENT
PHOSPHATASE-1

(Mus musculus) 		PF12689
(Acid_PPase) 		4 LEU A  16
LEU A  47
LEU A  80
LEU A  81
 None
 1.02A 2ab2B-1u7pA:
0.0		 2ab2B-1u7pA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yqd SINAPYL ALCOHOL
DEHYDROGENASE

(Populus
tremuloides) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 LEU A 264
LEU A 274
LEU A 286
LEU A 284
 None
 1.01A 2ab2B-1yqdA:
undetectable		 2ab2B-1yqdA:
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.
1z26 ARGONAUTE

(Pyrococcus
furiosus) 		PF02171
(Piwi)
PF12212
(PAZ_siRNAbind) 		4 LEU A 304
LEU A 300
LEU A 110
LEU A 106
 None
WO4  A 773 (-4.6A)
None
None
 1.02A 2ab2B-1z26A:
undetectable		 2ab2B-1z26A:
16.62
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.
2a0t SERINE/THREONINE-PRO
TEIN KINASE RAD53

(Saccharomyces
cerevisiae) 		PF00498
(FHA) 		4 LEU A 101
LEU A 124
LEU A  93
LEU A  48
 None
 0.89A 2ab2B-2a0tA:
undetectable		 2ab2B-2a0tA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bej SEGREGATION PROTEIN

(Thermus
thermophilus) 		PF13614
(AAA_31) 		4 LEU A  43
LEU A 117
LEU A  40
LEU A  83
 None
 1.00A 2ab2B-2bejA:
undetectable		 2ab2B-2bejA:
21.17
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.
2cbn RIBONUCLEASE Z

(Escherichia
coli) 		PF12706
(Lactamase_B_2) 		4 LEU A  57
LEU A  34
LEU A  24
CYH A  39
 None
 1.04A 2ab2B-2cbnA:
undetectable		 2ab2B-2cbnA:
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.
2dkh 3-HYDROXYBENZOATE
HYDROXYLASE

(Comamonas
testosteroni) 		PF01494
(FAD_binding_3)
PF07976
(Phe_hydrox_dim) 		4 LEU A 567
LEU A 568
LEU A 518
LEU A 520
 None
 0.81A 2ab2B-2dkhA:
undetectable		 2ab2B-2dkhA:
17.94
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.
2e8o SAM DOMAIN AND HD
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF07647
(SAM_2) 		4 LEU A  63
LEU A  66
LEU A  86
LEU A  85
 None
 1.02A 2ab2B-2e8oA:
undetectable		 2ab2B-2e8oA:
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.
2f06 CONSERVED
HYPOTHETICAL PROTEIN

(Bacteroides
thetaiotaomicron) 		no annotation 4 LEU A  31
LEU A  24
LEU A   6
LEU A  45
 None
 1.05A 2ab2B-2f06A:
undetectable		 2ab2B-2f06A:
19.27
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.
2gfp MULTIDRUG RESISTANCE
PROTEIN D

(Escherichia
coli) 		PF07690
(MFS_1) 		4 LEU A  10
LEU A   9
LEU A 120
LEU A 124
 None
 1.04A 2ab2B-2gfpA:
undetectable		 2ab2B-2gfpA:
20.88
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.
2h8o GERANYLTRANSTRANSFER
ASE

(Agrobacterium
fabrum) 		PF00348
(polyprenyl_synt) 		4 LEU A 161
LEU A 158
LEU A  73
LEU A  74
 None
 0.90A 2ab2B-2h8oA:
undetectable		 2ab2B-2h8oA:
22.54
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.
2klx GLUTAREDOXIN

(Bartonella
henselae) 		PF00462
(Glutaredoxin) 		4 LEU A  22
LEU A  21
LEU A  81
LEU A  80
 None
 0.98A 2ab2B-2klxA:
undetectable		 2ab2B-2klxA:
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.
2nn6 EXOSOME COMPONENT 6

(Homo sapiens) 		PF01138
(RNase_PH) 		4 LEU F 158
LEU F 122
LEU F 126
CYH F  64
 None
 0.96A 2ab2B-2nn6F:
undetectable		 2ab2B-2nn6F:
21.38
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.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 346
LEU A 349
LEU A 387
LEU A 391
 EST  A 596 (-4.4A)
EST  A 596 ( 4.1A)
EST  A 596 ( 4.2A)
EST  A 596 ( 4.6A)
 0.29A 2ab2B-2ocfA:
28.2		 2ab2B-2ocfA:
27.48
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.
2py8 HYPOTHETICAL PROTEIN
RBCX

(Synechocystis
sp. PCC 6803) 		PF02341
(RcbX) 		4 LEU A  61
LEU A  57
LEU A  67
LEU A  69
 None
 0.89A 2ab2B-2py8A:
undetectable		 2ab2B-2py8A:
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.
2pzi PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNG

(Mycobacterium
tuberculosis) 		PF00069
(Pkinase)
PF16918
(PknG_TPR)
PF16919
(PknG_rubred) 		4 LEU A 261
LEU A 257
LEU A 289
LEU A 291
 None
 1.03A 2ab2B-2pziA:
undetectable		 2ab2B-2pziA:
17.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2q3y ANCESTRAL CORTICIOD
RECEPTOR

(unidentified) 		PF00104
(Hormone_recep) 		4 LEU A  32
LEU A  35
LEU A  77
CYH A 112
 1CA  A 247 (-4.0A)
1CA  A 247 ( 4.4A)
1CA  A 247 ( 3.9A)
None
 0.21A 2ab2B-2q3yA:
38.4		 2ab2B-2q3yA:
68.73
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.
2v28 PHENYLALANINE-4-HYDR
OXYLASE

(Colwellia
psychrerythraea) 		PF00351
(Biopterin_H) 		4 LEU A  54
LEU A  51
LEU A 130
CYH A  79
 None
 1.01A 2ab2B-2v28A:
undetectable		 2ab2B-2v28A:
23.41
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.
2vvg KINESIN-2

(Giardia
intestinalis) 		PF00225
(Kinesin) 		4 LEU A 146
LEU A 144
LEU A 161
LEU A 163
 None
 0.96A 2ab2B-2vvgA:
undetectable		 2ab2B-2vvgA:
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.
2wm8 MAGNESIUM-DEPENDENT
PHOSPHATASE 1

(Homo sapiens) 		PF12689
(Acid_PPase) 		4 LEU A  17
LEU A  48
LEU A  81
LEU A  82
 None
 0.99A 2ab2B-2wm8A:
undetectable		 2ab2B-2wm8A:
19.93
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.
2x8n CV0863

(Chromobacterium
violaceum) 		PF10387
(DUF2442) 		4 LEU A  91
LEU A  92
LEU A  75
LEU A  25
 None
 0.86A 2ab2B-2x8nA:
undetectable		 2ab2B-2x8nA:
18.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 LEU A 209
LEU A 212
LEU A 161
LEU A 163
 None
 0.89A 2ab2B-2yevA:
undetectable		 2ab2B-2yevA:
15.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zpa UNCHARACTERIZED
PROTEIN YPFI

(Escherichia
coli) 		PF05127
(Helicase_RecD)
PF08351
(DUF1726)
PF13718
(GNAT_acetyltr_2)
PF17176
(tRNA_bind_3) 		4 LEU A 609
LEU A 612
LEU A 599
LEU A 601
 None
 1.03A 2ab2B-2zpaA:
undetectable		 2ab2B-2zpaA:
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.
3ad9 SARCOSINE OXIDASE
GAMMA SUBUNIT

(Corynebacterium
sp. U-96) 		PF04268
(SoxG) 		4 LEU C 163
LEU C 156
LEU C 122
LEU C 124
 None
 0.98A 2ab2B-3ad9C:
undetectable		 2ab2B-3ad9C:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3aqp PROBABLE SECDF
PROTEIN-EXPORT
MEMBRANE PROTEIN

(Thermus
thermophilus) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG) 		4 LEU A 421
LEU A 425
LEU A 297
LEU A 299
 None
 1.05A 2ab2B-3aqpA:
undetectable		 2ab2B-3aqpA:
17.25
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.
3bga BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		4 LEU A 855
LEU A1018
LEU A 777
LEU A 778
 None
 1.05A 2ab2B-3bgaA:
undetectable		 2ab2B-3bgaA:
14.06
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.
3d1j GLYCOGEN SYNTHASE

(Escherichia
coli) 		PF00534
(Glycos_transf_1)
PF08323
(Glyco_transf_5) 		4 LEU A  81
LEU A  41
LEU A  14
LEU A  13
 None
 1.02A 2ab2B-3d1jA:
undetectable		 2ab2B-3d1jA:
19.43
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.
3eat PYOVERDINE
BIOSYNTHESIS PROTEIN
PVCB

(Pseudomonas
aeruginosa) 		PF02668
(TauD) 		4 LEU X 249
LEU X  58
LEU X  41
CYH X  74
 None
 1.05A 2ab2B-3eatX:
undetectable		 2ab2B-3eatX:
21.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gq2 GENERAL VESICULAR
TRANSPORT FACTOR
P115

(Bos taurus) 		PF04869
(Uso1_p115_head) 		4 LEU A 494
LEU A 497
LEU A 475
LEU A 474
 None
 0.95A 2ab2B-3gq2A:
undetectable		 2ab2B-3gq2A:
17.28
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.
3hee RIBOSE-5-PHOSPHATE
ISOMERASE

(Ruminiclostridium
thermocellum) 		PF02502
(LacAB_rpiB) 		4 LEU A  14
LEU A 106
LEU A 115
LEU A 117
 None
 1.02A 2ab2B-3heeA:
undetectable		 2ab2B-3heeA:
18.37
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.
3hn2 2-DEHYDROPANTOATE
2-REDUCTASE

(Geobacter
metallireducens) 		PF02558
(ApbA)
PF08546
(ApbA_C) 		4 LEU A 198
LEU A 194
LEU A 297
LEU A 296
 None
 0.96A 2ab2B-3hn2A:
undetectable		 2ab2B-3hn2A:
20.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jb9 PRE-MRNA-SPLICING
FACTOR SPP42

(Schizosaccharomyces
pombe) 		PF08082
(PRO8NT)
PF08083
(PROCN)
PF10596
(U6-snRNA_bdg)
PF10597
(U5_2-snRNA_bdg)
PF10598
(RRM_4)
PF12134
(PRP8_domainIV) 		4 LEU A 866
LEU A 869
LEU A 887
LEU A 889
 None
 0.91A 2ab2B-3jb9A:
undetectable		 2ab2B-3jb9A:
8.57
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.
3kb5 TRIPARTITE
MOTIF-CONTAINING
PROTEIN 72

(Homo sapiens) 		PF00622
(SPRY)
PF13765
(PRY) 		4 LEU A 424
LEU A 415
LEU A 383
LEU A 382
 None
 1.01A 2ab2B-3kb5A:
undetectable		 2ab2B-3kb5A:
21.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3kba PROGESTERONE
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 718
LEU A 721
LEU A 763
CYH A 798
 WOW  A   1 (-4.2A)
WOW  A   1 ( 4.3A)
WOW  A   1 ( 4.0A)
WOW  A   1 ( 4.1A)
 0.29A 2ab2B-3kbaA:
35.3		 2ab2B-3kbaA:
52.36
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.
3lhq ACRAB OPERON
REPRESSOR (TETR/ACRR
FAMILY)

(Salmonella
enterica) 		PF00440
(TetR_N)
PF08361
(TetR_C_2) 		4 LEU A 199
LEU A 198
LEU A 208
CYH A 148
 None
 0.96A 2ab2B-3lhqA:
undetectable		 2ab2B-3lhqA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3odm PHOSPHOENOLPYRUVATE
CARBOXYLASE

(Clostridium
perfringens) 		PF14010
(PEPcase_2) 		4 LEU A 429
LEU A 430
LEU A 414
CYH A 316
 None
 1.05A 2ab2B-3odmA:
undetectable		 2ab2B-3odmA:
19.82
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.
3ph3 RIBOSE-5-PHOSPHATE
ISOMERASE

(Ruminiclostridium
thermocellum) 		PF02502
(LacAB_rpiB) 		4 LEU A  14
LEU A 106
LEU A 115
LEU A 117
 None
 1.05A 2ab2B-3ph3A:
undetectable		 2ab2B-3ph3A:
19.79
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.
3qrx CENTRIN
MELITTIN

(Apis mellifera;
Chlamydomonas
reinhardtii) 		PF01372
(Melittin)
PF13499
(EF-hand_7) 		4 LEU B  13
LEU B  16
LEU A 134
LEU A 123
 None
 0.92A 2ab2B-3qrxB:
undetectable		 2ab2B-3qrxB:
8.14
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.
3qvu SULFOTRANSFERASE 1A1

(Homo sapiens) 		PF00685
(Sulfotransfer_1) 		4 LEU A  82
LEU A  31
LEU A 113
LEU A 114
 None
 1.02A 2ab2B-3qvuA:
undetectable		 2ab2B-3qvuA:
20.96
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.
3r4r HYPOTHETICAL
FIMBRIAL ASSEMBLY
PROTEIN

(Parabacteroides
distasonis) 		PF06321
(P_gingi_FimA) 		4 LEU A  40
LEU A  43
LEU A 187
CYH A  69
 None
 0.99A 2ab2B-3r4rA:
undetectable		 2ab2B-3r4rA:
22.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ry9 ANCESTRAL
GLUCOCORTICOID
RECEPTOR 1

(synthetic
construct) 		PF00104
(Hormone_recep) 		4 LEU A  32
LEU A  35
LEU A  77
CYH A 112
 1CA  A 249 (-3.9A)
1CA  A 249 ( 4.4A)
1CA  A 249 ( 4.1A)
None
 0.16A 2ab2B-3ry9A:
37.6		 2ab2B-3ry9A:
65.93
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.
3tr5 PEPTIDE CHAIN
RELEASE FACTOR 3

(Coxiella
burnetii) 		PF00009
(GTP_EFTU)
PF16658
(RF3_C) 		4 LEU A 409
LEU A 408
LEU A 415
LEU A 423
 None
 0.96A 2ab2B-3tr5A:
undetectable		 2ab2B-3tr5A:
20.23
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.
3u9j F-BOX/LRR-REPEAT
PROTEIN 5

(Homo sapiens) 		PF01814
(Hemerythrin) 		4 LEU A  44
LEU A  47
LEU A  89
LEU A  91
 None
 0.82A 2ab2B-3u9jA:
undetectable		 2ab2B-3u9jA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wwx S12 FAMILY PEPTIDASE

(Streptomyces
sp. 82F2) 		PF00144
(Beta-lactamase) 		4 LEU A 298
LEU A 293
LEU A 318
LEU A 320
 None
 1.04A 2ab2B-3wwxA:
undetectable		 2ab2B-3wwxA:
22.44
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.
4dyl TYROSINE-PROTEIN
KINASE FES/FPS

(Homo sapiens) 		no annotation 4 LEU A 102
LEU A 105
LEU A  24
LEU A  26
 None
 0.96A 2ab2B-4dylA:
undetectable		 2ab2B-4dylA:
22.54
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.
4e10 PROTELOMERASE

(Agrobacterium
fabrum) 		PF16684
(Telomere_res) 		4 LEU A 365
LEU A 368
LEU A 304
CYH A 235
 None
 0.69A 2ab2B-4e10A:
undetectable		 2ab2B-4e10A:
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.
4ege DIPEPTIDASE PEPE

(Mycobacterium
ulcerans) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N) 		4 LEU A 123
LEU A 122
LEU A 129
LEU A 132
 None
 1.00A 2ab2B-4egeA:
undetectable		 2ab2B-4egeA:
20.96
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.
4f41 PROTELOMERASE

(Agrobacterium
fabrum) 		PF16684
(Telomere_res) 		4 LEU A 365
LEU A 368
LEU A 304
CYH A 235
 None
 0.76A 2ab2B-4f41A:
undetectable		 2ab2B-4f41A:
22.09
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.
4g1h SORTASE FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF04203
(Sortase) 		4 LEU A 130
LEU A 153
LEU A 216
CYH A 218
 None
 1.05A 2ab2B-4g1hA:
undetectable		 2ab2B-4g1hA:
20.71
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.
4hyd PUTATIVE
UNCHARACTERIZED
PROTEIN

(Methanoculleus
marisnigri) 		PF06550
(SPP) 		4 LEU A 256
LEU A 259
LEU A  10
LEU A  14
 None
 1.03A 2ab2B-4hydA:
undetectable		 2ab2B-4hydA:
23.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4i7i RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		4 LEU A 522
LEU A 525
LEU A 484
LEU A 486
 None
 0.73A 2ab2B-4i7iA:
undetectable		 2ab2B-4i7iA:
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.
4i96 RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF01365
(RYDR_ITPR)
PF02815
(MIR) 		4 LEU A 522
LEU A 525
LEU A 484
LEU A 486
 None
 0.77A 2ab2B-4i96A:
undetectable		 2ab2B-4i96A:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4iuw NEUTRAL
ENDOPEPTIDASE

(Lactobacillus
rhamnosus) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		4 LEU A 286
LEU A 289
LEU A 276
LEU A 275
 None
 1.02A 2ab2B-4iuwA:
undetectable		 2ab2B-4iuwA:
20.03
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.
4jeu SYNTAXIN-BINDING
PROTEIN 1

(Rattus
norvegicus) 		PF00995
(Sec1) 		4 LEU A 287
LEU A 291
LEU A 350
LEU A 348
 None
 1.00A 2ab2B-4jeuA:
undetectable		 2ab2B-4jeuA:
19.45
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.
4k7e NUCLEOPROTEIN

(Argentinian
mammarenavirus) 		PF17290
(Arena_ncap_C) 		4 LEU A 377
LEU A 379
LEU A 472
LEU A 470
 None
 1.03A 2ab2B-4k7eA:
undetectable		 2ab2B-4k7eA:
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.
4keg MALTOSE-BINDING
PERIPLASMIC/PALATE
LUNG AND NASAL
EPITHELIUM CLONE
FUSION PROTEIN

(Escherichia
coli;
Homo sapiens) 		PF01273
(LBP_BPI_CETP)
PF13416
(SBP_bac_8) 		4 LEU A1204
LEU A1207
LEU A1139
LEU A1151
 None
 0.90A 2ab2B-4kegA:
undetectable		 2ab2B-4kegA:
19.22
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.
4lcm TRANSESTERASE

(Aspergillus
terreus) 		PF00144
(Beta-lactamase) 		4 LEU A  81
LEU A  80
LEU A 293
CYH A 216
 None
 0.84A 2ab2B-4lcmA:
undetectable		 2ab2B-4lcmA:
21.55
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.
4ma5 PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE, ATPASE
SUBUNIT

(Francisella
tularensis) 		PF02222
(ATP-grasp) 		4 LEU A 315
LEU A 318
LEU A 341
CYH A 305
 None
 0.83A 2ab2B-4ma5A:
undetectable		 2ab2B-4ma5A:
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.
4mso SERINE
HYDROXYMETHYLTRANSFE
RASE

(Burkholderia
cenocepacia) 		PF00464
(SHMT) 		4 LEU A 305
LEU A 321
LEU A 318
LEU A 362
 None
 1.04A 2ab2B-4msoA:
undetectable		 2ab2B-4msoA:
20.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4p6w GLUCOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 563
LEU A 566
LEU A 608
CYH A 643
 MOF  A 801 (-3.9A)
MOF  A 801 ( 4.6A)
MOF  A 801 ( 4.6A)
MOF  A 801 ( 3.7A)
 0.65A 2ab2B-4p6wA:
34.5		 2ab2B-4p6wA:
56.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rvq PRE-MRNA SPLICING
HELICASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		no annotation 4 LEU A 381
LEU A 378
LEU A 402
LEU A 406
 None
 0.99A 2ab2B-4rvqA:
undetectable		 2ab2B-4rvqA:
17.52
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.
4rye D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Mycobacterium
tuberculosis) 		PF00768
(Peptidase_S11) 		4 LEU A 116
LEU A 117
LEU A  85
LEU A  83
 None
 1.03A 2ab2B-4ryeA:
undetectable		 2ab2B-4ryeA:
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.
4u06 LIC10831

(Leptospira
interrogans) 		PF12799
(LRR_4)
PF13855
(LRR_8) 		4 LEU A 314
LEU A 291
LEU A 321
LEU A 327
 None
 0.95A 2ab2B-4u06A:
undetectable		 2ab2B-4u06A:
24.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4udb MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 LEU A 769
LEU A 772
LEU A 810
LEU A 814
CYH A 849
 CV7  A1987 (-4.1A)
CV7  A1987 ( 4.5A)
CV7  A1987 (-4.0A)
CV7  A1987 ( 4.0A)
CV7  A1987 ( 4.2A)
 0.64A 2ab2B-4udbA:
36.4		 2ab2B-4udbA:
91.27
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.
4uwa RYANODINE RECEPTOR 1

(Oryctolagus
cuniculus) 		PF00622
(SPRY)
PF01365
(RYDR_ITPR)
PF02026
(RyR)
PF02815
(MIR)
PF08709
(Ins145_P3_rec) 		4 LEU A 522
LEU A 525
LEU A 484
LEU A 486
 None
 0.81A 2ab2B-4uwaA:
undetectable		 2ab2B-4uwaA:
5.89
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.
4x8f RIBOKINASE

(Vibrio cholerae) 		PF00294
(PfkB) 		4 LEU A 135
LEU A 136
LEU A 180
LEU A 162
 None
 0.91A 2ab2B-4x8fA:
undetectable		 2ab2B-4x8fA:
25.44
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.
4xe3 CYTOCHROME P-450

(Streptomyces
antibioticus) 		PF00067
(p450) 		4 LEU A 160
LEU A 161
LEU A 242
LEU A 241
 None
None
None
HEM  A 501 (-4.2A)
 1.02A 2ab2B-4xe3A:
2.5		 2ab2B-4xe3A:
22.57
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.
4z0t OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY

(Brucella ovis) 		PF00106
(adh_short) 		4 LEU A   9
LEU A  11
LEU A 131
LEU A 130
 None
 1.04A 2ab2B-4z0tA:
undetectable		 2ab2B-4z0tA:
21.66
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.
5a7d INSCUTEABLE

(Drosophila
melanogaster) 		no annotation 4 LEU L 587
LEU L 539
LEU L 522
LEU L 523
 None
 1.03A 2ab2B-5a7dL:
undetectable		 2ab2B-5a7dL:
24.58
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.
5b5r GASDERMIN-A3

(Mus musculus) 		PF04598
(Gasdermin) 		4 LEU A 438
LEU A 441
LEU A 373
LEU A 375
 None
 0.97A 2ab2B-5b5rA:
2.7		 2ab2B-5b5rA:
22.70
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.
5by8 RPF2
RRS1

(Aspergillus
nidulans) 		PF04427
(Brix)
PF04939
(RRS1) 		4 LEU B  88
LEU B  33
LEU B  37
LEU A 145
 None
 1.03A 2ab2B-5by8B:
undetectable		 2ab2B-5by8B:
20.08
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.
5e3c DIPEPTIDYL PEPTIDASE
3

(Homo sapiens) 		PF03571
(Peptidase_M49) 		4 LEU A 354
LEU A 353
LEU A 449
LEU A 452
 None
 1.03A 2ab2B-5e3cA:
undetectable		 2ab2B-5e3cA:
19.64
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.
5e3c DIPEPTIDYL PEPTIDASE
3

(Homo sapiens) 		PF03571
(Peptidase_M49) 		4 LEU A 449
LEU A 452
LEU A 354
LEU A 353
 None
 1.04A 2ab2B-5e3cA:
undetectable		 2ab2B-5e3cA:
19.64
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.
5fyq NAD-DEPENDENT
PROTEIN DEACETYLASE
SIRTUIN-2

(Homo sapiens) 		PF02146
(SIR2) 		4 LEU A 331
LEU A 335
LEU A 154
LEU A 155
 None
 0.99A 2ab2B-5fyqA:
undetectable		 2ab2B-5fyqA:
24.20
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.
5gxu NADPH--CYTOCHROME
P450 REDUCTASE 2

(Arabidopsis
thaliana) 		PF00175
(NAD_binding_1)
PF00258
(Flavodoxin_1)
PF00667
(FAD_binding_1) 		4 LEU A 413
LEU A 461
LEU A 369
LEU A 370
 None
 1.00A 2ab2B-5gxuA:
undetectable		 2ab2B-5gxuA:
17.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5mwp MINERALOCORTICOID
RECEPTOR

(Homo sapiens) 		no annotation 4 LEU A 769
LEU A 772
LEU A 814
CYH A 849
 ECV  A1101 (-4.7A)
ECV  A1101 ( 3.9A)
ECV  A1101 (-4.1A)
ECV  A1101 (-3.8A)
 0.21A 2ab2B-5mwpA:
39.3		 2ab2B-5mwpA:
72.29
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.
5mzo UDP-GLUCOSE-GLYCOPRO
TEIN
GLUCOSYLTRANSFERASE-
LIKE PROTEIN

(Chaetomium
thermophilum) 		PF06427
(UDP-g_GGTase) 		4 LEU A 355
LEU A 353
LEU A 941
LEU A 933
 None
 1.03A 2ab2B-5mzoA:
undetectable		 2ab2B-5mzoA:
10.50
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.
5toa ESTROGEN RECEPTOR
BETA

(Homo sapiens) 		PF00104
(Hormone_recep) 		4 LEU A 298
LEU A 301
LEU A 339
LEU A 343
 EST  A 601 (-4.1A)
EST  A 601 ( 4.3A)
EST  A 601 (-3.9A)
EST  A 601 ( 4.4A)
 0.33A 2ab2B-5toaA:
25.3		 2ab2B-5toaA:
28.67
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.
5u4v RHO
GTPASE-ACTIVATING
PROTEIN 5

(Homo sapiens) 		no annotation 4 LEU A 668
LEU A 700
LEU A 698
CYH A 658
 None
 1.04A 2ab2B-5u4vA:
undetectable		 2ab2B-5u4vA:
20.96
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.
5uag DNA-DIRECTED RNA
POLYMERASE SUBUNIT
ALPHA

(Escherichia
coli) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		4 LEU A  85
LEU A  88
LEU A 100
LEU A 102
 None
 0.98A 2ab2B-5uagA:
undetectable		 2ab2B-5uagA:
21.60
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.
5uai METHIONYL-TRNA
FORMYLTRANSFERASE

(Pseudomonas
aeruginosa) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		4 LEU A 280
LEU A 282
LEU A 312
LEU A 215
 None
 1.05A 2ab2B-5uaiA:
undetectable		 2ab2B-5uaiA:
21.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5uc1 GLUCOCORTICOID
RECEPTOR

(Heterocephalus
glaber) 		no annotation 4 LEU A 559
LEU A 562
LEU A 604
CYH A 639
 486  A 801 (-4.7A)
486  A 801 ( 4.8A)
486  A 801 ( 3.8A)
486  A 801 ( 3.9A)
 0.77A 2ab2B-5uc1A:
23.1		 2ab2B-5uc1A:
53.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ufs ANCESTRAL
GLUCOCORTICOID
RECEPTOR2

(unidentified) 		PF00104
(Hormone_recep) 		4 LEU A  32
LEU A  35
LEU A  77
CYH A 112
 1TA  A 301 (-3.5A)
1TA  A 301 ( 3.6A)
1TA  A 301 ( 3.4A)
1TA  A 301 ( 3.6A)
 0.30A 2ab2B-5ufsA:
36.5		 2ab2B-5ufsA:
59.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vhi 26S PROTEASOME
NON-ATPASE
REGULATORY SUBUNIT 8

(Homo sapiens) 		PF00004
(AAA) 		4 LEU d  30
LEU d  33
LEU d  48
LEU d  50
 None
 1.03A 2ab2B-5vhid:
undetectable		 2ab2B-5vhid:
24.32
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.
5w1d PROTOCADHERIN-15

(Mus musculus) 		no annotation 4 LEU A 614
LEU A 615
LEU A 642
LEU A 665
 None
 0.97A 2ab2B-5w1dA:
undetectable		 2ab2B-5w1dA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5w94 MAU2 CHROMATID
COHESION FACTOR
HOMOLOG

(Saccharomyces
cerevisiae) 		PF10345
(Cohesin_load) 		4 LEU A 221
LEU A 218
LEU A 206
LEU A 207
 None
 0.92A 2ab2B-5w94A:
undetectable		 2ab2B-5w94A:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wu3 SPECKLE TARGETED
PIP5K1A-REGULATED
POLY(A) POLYMERASE

(Homo sapiens) 		PF03828
(PAP_assoc) 		4 LEU A 511
LEU A 520
LEU A 530
LEU A 547
 None
 1.05A 2ab2B-5wu3A:
undetectable		 2ab2B-5wu3A:
20.04
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.
5xg2 CHROMOSOME PARTITION
PROTEIN SMC

(Pyrococcus
yayanosii) 		PF05483
(SCP-1) 		4 LEU A 443
LEU A 446
LEU A 712
LEU A 714
 None
 0.95A 2ab2B-5xg2A:
undetectable		 2ab2B-5xg2A:
23.32
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 LEU C 793
LEU C 796
LEU C 859
LEU C 862
 None
 1.05A 2ab2B-5y3rC:
undetectable		 2ab2B-5y3rC:
5.39
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.
5zqe -

(-) 		no annotation 4 LEU A 174
LEU A 177
LEU A 221
CYH A 232
 None
 0.91A 2ab2B-5zqeA:
undetectable		 2ab2B-5zqeA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6bcq TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY M
MEMBER 4

(Mus musculus) 		no annotation 4 LEU B 569
LEU B 568
LEU B 477
LEU B 478
 None
 1.01A 2ab2B-6bcqB:
undetectable		 2ab2B-6bcqB:
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.
6cri -

(-) 		no annotation 4 LEU G 197
LEU G 198
LEU G 191
LEU G 182
 None
 1.05A 2ab2B-6criG:
undetectable		 2ab2B-6criG:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f8l -

(-) 		no annotation 4 LEU G 453
LEU G 428
LEU G 408
LEU G 406
 None
 1.05A 2ab2B-6f8lG:
undetectable		 2ab2B-6f8lG:
undetectable