SIMILAR PATTERNS OF AMINO ACIDS FOR 1IBG_H_OBNH1_2

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ai1 IGG1-KAPPA 59.1 FAB
(HEAVY CHAIN)

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR H  73
SER H  74
SER H  70
ARG H  71
 None
 1.16A 1ibgL-1ai1H:
14.4		 1ibgL-1ai1H:
31.56
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.
1c9w CHO REDUCTASE

(Cricetulus
griseus) 		PF00248
(Aldo_ket_red) 		4 THR A  19
SER A  22
SER A  76
LEU A 104
 None
 1.17A 1ibgL-1c9wA:
0.0		 1ibgL-1c9wA:
19.18
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.
1evs ONCOSTATIN M

(Homo sapiens) 		PF01291
(LIF_OSM) 		4 HIS A 178
SER A 179
ARG A 182
LEU A  62
 None
 1.16A 1ibgL-1evsA:
undetectable		 1ibgL-1evsA:
19.46
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.
1ewr DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 SER A 290
HIS A 173
ARG A 172
LEU A 166
 None
 0.93A 1ibgL-1ewrA:
0.0		 1ibgL-1ewrA:
15.26
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.
1fnz BARK AGGLUTININ I,
POLYPEPTIDE A

(Robinia
pseudoacacia) 		PF00139
(Lectin_legB) 		4 THR A  85
ARG A 139
TYR A 183
LEU A 181
 None
 1.15A 1ibgL-1fnzA:
1.1		 1ibgL-1fnzA:
23.08
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.
1gl6 ATPASE

(Escherichia
coli) 		PF10412
(TrwB_AAD_bind) 		4 THR A 338
SER A 339
TYR A 395
LEU A 403
 None
 1.09A 1ibgL-1gl6A:
0.0		 1ibgL-1gl6A:
20.28
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.
1hzo BETA-LACTAMASE

(Proteus
vulgaris) 		PF13354
(Beta-lactamase2) 		4 THR A 244
SER A 237
TYR A  39
LEU A  36
 None
MES  A1000 (-2.7A)
None
None
 1.16A 1ibgL-1hzoA:
0.0		 1ibgL-1hzoA:
23.25
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.
1lgf P450 MONOOXYGENASE

(Amycolatopsis
orientalis) 		PF00067
(p450) 		4 THR A  63
SER A  62
HIS A 345
LEU A 348
 None
None
HEM  A 430 (-3.8A)
HEM  A 430 ( 4.4A)
 1.10A 1ibgL-1lgfA:
0.0		 1ibgL-1lgfA:
18.84
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.
1nne DNA MISMATCH REPAIR
PROTEIN MUTS

(Thermus
aquaticus) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05190
(MutS_IV)
PF05192
(MutS_III) 		4 SER A 290
HIS A 173
ARG A 172
LEU A 166
 None
 0.99A 1ibgL-1nneA:
0.5		 1ibgL-1nneA:
14.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qgc PROTEIN (VIRUS
CAPSID PROTEIN VP2)

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		5 THR 2  43
SER 2  42
HIS 2 209
TYR 2  98
LEU 2  94
 None
 1.32A 1ibgL-1qgc2:
0.0		 1ibgL-1qgc2:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rxq YFIT

(Bacillus
subtilis) 		PF12867
(DinB_2) 		4 SER A 110
HIS A  66
SER A 104
ARG A  62
 None
 1.07A 1ibgL-1rxqA:
undetectable		 1ibgL-1rxqA:
22.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zun SULFATE ADENYLATE
TRANSFERASE, SUBUNIT
1/ADENYLYLSULFATE
KINASE
SULFATE
ADENYLYLTRANSFERASE
SUBUNIT 2

(Pseudomonas
syringae;
Pseudomonas
syringae group
genomosp. 3) 		PF00009
(GTP_EFTU)
PF01507
(PAPS_reduct) 		4 THR B 127
SER B 126
ARG B  26
LEU A   5
 None
 1.12A 1ibgL-1zunB:
undetectable		 1ibgL-1zunB:
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.
2ctr DNAJ HOMOLOG
SUBFAMILY B MEMBER 9

(Homo sapiens) 		PF00226
(DnaJ) 		4 THR A  77
SER A  78
TYR A  10
LEU A  59
 None
 1.13A 1ibgL-2ctrA:
undetectable		 1ibgL-2ctrA:
15.28
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.
2d8j FYN-RELATED KINASE

(Mus musculus) 		PF00018
(SH3_1) 		4 THR A  37
SER A  38
TYR A   9
LEU A  48
 None
 1.00A 1ibgL-2d8jA:
undetectable		 1ibgL-2d8jA:
18.85
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.
2duw PUTATIVE COA-BINDING
PROTEIN

(Klebsiella
pneumoniae) 		PF13380
(CoA_binding_2) 		4 THR A  97
SER A 119
TYR A  41
LEU A  36
 None
 0.90A 1ibgL-2duwA:
undetectable		 1ibgL-2duwA:
21.74
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.
2gl7 B-CELL LYMPHOMA 9
PROTEIN

(Homo sapiens) 		PF11502
(BCL9) 		4 SER C 352
SER C 362
ARG C 359
LEU C 366
 None
 1.17A 1ibgL-2gl7C:
undetectable		 1ibgL-2gl7C:
12.15
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.
2hes YDR267CP

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		4 SER X  19
HIS X 158
SER X 203
LEU X 214
 None
 1.16A 1ibgL-2hesX:
undetectable		 1ibgL-2hesX:
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.
2n8a POLY [ADP-RIBOSE]
POLYMERASE 1

(Homo sapiens) 		PF00645
(zf-PARP) 		4 SER A   4
ARG A  10
TYR A  13
LEU A  33
 None
 0.99A 1ibgL-2n8aA:
undetectable		 1ibgL-2n8aA:
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.
2okj GLUTAMATE
DECARBOXYLASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		4 THR A 136
SER A 135
ARG A 181
TYR A 178
 None
 1.12A 1ibgL-2okjA:
undetectable		 1ibgL-2okjA:
18.07
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.
2oy0 METHYLTRANSFERASE

(West Nile virus) 		PF01728
(FtsJ) 		4 THR A 236
SER A 237
ARG A 208
LEU A  65
 None
 1.15A 1ibgL-2oy0A:
undetectable		 1ibgL-2oy0A:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2px5 ENVELOPE PROTEIN M
(MATRIX PROTEIN)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)]
GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)

(Murray Valley
encephalitis
virus) 		PF01728
(FtsJ) 		4 THR A 236
SER A 237
ARG A 208
LEU A  65
 None
 1.08A 1ibgL-2px5A:
undetectable		 1ibgL-2px5A:
19.33
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.
2xxl GRAM-POSITIVE
SPECIFIC SERINE
PROTEASE, ISOFORM B

(Drosophila
melanogaster) 		PF00089
(Trypsin)
PF12032
(CLIP) 		4 THR A 259
SER A 258
SER A 313
TYR A 123
 None
 1.04A 1ibgL-2xxlA:
undetectable		 1ibgL-2xxlA:
19.62
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.
2yut PUTATIVE SHORT-CHAIN
OXIDOREDUCTASE

(Thermus
thermophilus) 		PF00106
(adh_short) 		4 THR A   6
SER A  28
HIS A  72
LEU A 145
 None
 1.12A 1ibgL-2yutA:
undetectable		 1ibgL-2yutA:
19.57
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.
2ziu CROSSOVER JUNCTION
ENDONUCLEASE EME1
MUS81 PROTEIN

(Danio rerio;
Homo sapiens) 		PF02732
(ERCC4) 		4 THR A 560
SER A 559
TYR B 514
LEU B 510
 None
 1.06A 1ibgL-2ziuA:
undetectable		 1ibgL-2ziuA:
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.
3a2f DNA POLYMERASE
DNA POLYMERASE
SLIDING CLAMP

(Pyrococcus
furiosus) 		PF00136
(DNA_pol_B)
PF00705
(PCNA_N)
PF02747
(PCNA_C)
PF03104
(DNA_pol_B_exo1) 		4 THR A 767
SER A 768
SER B  44
ARG B  45
 None
 1.00A 1ibgL-3a2fA:
undetectable		 1ibgL-3a2fA:
12.48
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.
3bzm MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE

(Escherichia
coli) 		PF00425
(Chorismate_bind) 		4 HIS A 223
SER A 214
ARG A 215
LEU A 427
 None
 1.06A 1ibgL-3bzmA:
undetectable		 1ibgL-3bzmA:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3e99 BENZOATE
1,2-DIOXYGENASE BETA
SUBUNIT

(Burkholderia
mallei) 		PF00866
(Ring_hydroxyl_B) 		4 THR A  89
SER A 116
HIS A  91
SER A  17
 None
 1.09A 1ibgL-3e99A:
undetectable		 1ibgL-3e99A:
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.
3eni BACTERIOCHLOROPHYLL
A PROTEIN

(Chlorobaculum
tepidum) 		PF02327
(BChl_A) 		4 SER A 117
SER A 220
ARG A 221
LEU A 207
 None
BCL  A 371 ( 3.8A)
None
None
 1.08A 1ibgL-3eniA:
undetectable		 1ibgL-3eniA:
18.57
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.
3fdd L-ASPARTATE-BETA-DEC
ARBOXYLASE

(Comamonas
testosteroni) 		PF00155
(Aminotran_1_2) 		4 SER A 356
ARG A 355
TYR A 354
LEU A 357
 None
 1.14A 1ibgL-3fddA:
undetectable		 1ibgL-3fddA:
17.21
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.
3g2f BONE MORPHOGENETIC
PROTEIN RECEPTOR
TYPE-2

(Homo sapiens) 		PF00069
(Pkinase) 		4 SER A 428
ARG A 419
TYR A 290
LEU A 304
 None
 0.99A 1ibgL-3g2fA:
undetectable		 1ibgL-3g2fA:
19.65
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.
3gs6 BETA-HEXOSAMINIDASE

(Vibrio cholerae) 		PF00933
(Glyco_hydro_3) 		4 THR A 176
HIS A 207
SER A 219
LEU A 225
 None
 1.11A 1ibgL-3gs6A:
undetectable		 1ibgL-3gs6A:
19.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gse MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE

(Yersinia pestis) 		PF00425
(Chorismate_bind) 		4 HIS A 241
SER A 232
ARG A 233
LEU A 445
 None
 1.04A 1ibgL-3gseA:
undetectable		 1ibgL-3gseA:
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.
3hrv TOXIN COREGULATED
PILIN

(Vibrio cholerae) 		PF05946
(TcpA) 		4 SER A  53
ARG A  52
TYR A  51
LEU A  54
 None
GOL  A1002 (-3.1A)
None
None
 1.11A 1ibgL-3hrvA:
undetectable		 1ibgL-3hrvA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k94 THIAMIN
PYROPHOSPHOKINASE

(Geobacillus
thermodenitrificans) 		PF04263
(TPK_catalytic)
PF04265
(TPK_B1_binding) 		4 THR A 183
SER A 182
SER A 187
TYR A 171
 None
None
CSO  A 185 ( 3.2A)
None
 1.00A 1ibgL-3k94A:
undetectable		 1ibgL-3k94A:
19.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3l6n METALLO-BETA-LACTAMA
SE

(Chryseobacterium
indologenes) 		PF00753
(Lactamase_B) 		4 HIS A  85
ARG A  84
TYR A  38
LEU A  77
 None
 1.16A 1ibgL-3l6nA:
undetectable		 1ibgL-3l6nA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lkz NON-STRUCTURAL
PROTEIN 5

(West Nile virus) 		PF01728
(FtsJ) 		4 THR A 236
SER A 237
ARG A 208
LEU A  65
 None
 1.16A 1ibgL-3lkzA:
undetectable		 1ibgL-3lkzA:
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.
3m1u PUTATIVE
GAMMA-D-GLUTAMYL-L-D
IAMINO ACID
ENDOPEPTIDASE

(Desulfovibrio
vulgaris) 		PF00877
(NLPC_P60)
PF12912
(N_NLPC_P60)
PF12913
(SH3_6)
PF12914
(SH3_7) 		4 THR A 432
SER A 433
HIS A 408
TYR A 322
 None
None
None
GOL  A   8 ( 4.9A)
 0.99A 1ibgL-3m1uA:
undetectable		 1ibgL-3m1uA:
18.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mj8 STIMULATORY HAMSTER
ANTIBODY HL4E10 FAB
HEAVY CHAIN

(Cricetulus
migratorius) 		no annotation 4 THR H  73
SER H  74
SER H  70
ARG H  71
 None
 1.14A 1ibgL-3mj8H:
17.0		 1ibgL-3mj8H:
27.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mvd REGULATOR OF
CHROMOSOME
CONDENSATION

(Drosophila
melanogaster) 		PF00415
(RCC1) 		4 THR K 110
SER K 111
SER K  97
LEU K  87
 None
 1.08A 1ibgL-3mvdK:
undetectable		 1ibgL-3mvdK:
19.62
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.
3omn CYTOCHROME C
OXIDASE, AA3 TYPE,
SUBUNIT I

(Rhodobacter
sphaeroides) 		PF00115
(COX1) 		4 THR A 187
SER A 186
TYR A 175
LEU A 279
 None
 1.02A 1ibgL-3omnA:
undetectable		 1ibgL-3omnA:
18.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3opy 6-PHOSPHOFRUCTO-1-KI
NASE ALPHA-SUBUNIT

(Komagataella
pastoris) 		PF00365
(PFK) 		4 SER A 597
HIS A 629
SER A 624
TYR A 586
 None
 0.70A 1ibgL-3opyA:
undetectable		 1ibgL-3opyA:
14.33
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.
3orf DIHYDROPTERIDINE
REDUCTASE

(Dictyostelium
discoideum) 		PF00106
(adh_short) 		4 THR A 132
SER A 133
SER A 126
LEU A 169
 None
 1.16A 1ibgL-3orfA:
undetectable		 1ibgL-3orfA:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q6z POLY [ADP-RIBOSE]
POLYMERASE 14

(Homo sapiens) 		PF01661
(Macro) 		4 SER A 838
HIS A 879
TYR A 911
LEU A 907
 None
 0.99A 1ibgL-3q6zA:
undetectable		 1ibgL-3q6zA:
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.
3qj3 CATHEPSIN L-LIKE
PROTEIN

(Tenebrio
molitor) 		PF00112
(Peptidase_C1)
PF08246
(Inhibitor_I29) 		4 SER A 288
SER A 249
TYR A  56
LEU A  58
 None
 1.05A 1ibgL-3qj3A:
undetectable		 1ibgL-3qj3A:
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.
3sfy CRYPTOCOCCUS
NEOFORMANS PROTEIN
FARNESYLTRANSFERASE
ALPHA SUBUNIT

(Cryptococcus
neoformans) 		PF01239
(PPTA) 		4 THR A  85
SER A  86
ARG A 121
LEU A 116
 None
 1.03A 1ibgL-3sfyA:
undetectable		 1ibgL-3sfyA:
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.
3stt METHYLKETONE
SYNTHASE I

(Solanum
habrochaites) 		PF12697
(Abhydrolase_6) 		4 THR A  18
HIS A  86
SER A 111
LEU A 223
 DKA  A 266 (-2.9A)
None
None
None
 0.98A 1ibgL-3sttA:
undetectable		 1ibgL-3sttA:
22.22
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.
3syj ADHESION AND
PENETRATION PROTEIN
AUTOTRANSPORTER

(Haemophilus
influenzae) 		PF02395
(Peptidase_S6)
PF03212
(Pertactin) 		4 THR A 159
SER A 160
TYR A 231
LEU A 221
 None
 1.00A 1ibgL-3syjA:
undetectable		 1ibgL-3syjA:
12.54
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.
3tdp FORMATE/NITRITE
TRANSPORTER

(Clostridioides
difficile) 		PF01226
(Form_Nir_trans) 		4 THR A 104
SER A 105
TYR A 250
LEU A   6
 None
BOG  A 267 (-2.8A)
None
None
 1.03A 1ibgL-3tdpA:
undetectable		 1ibgL-3tdpA:
20.07
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.
3ucq AMYLOSUCRASE

(Deinococcus
geothermalis) 		PF00128
(Alpha-amylase) 		4 THR A 386
SER A 385
TYR A 352
LEU A 494
 None
None
GOL  A 721 (-3.6A)
None
 1.12A 1ibgL-3ucqA:
undetectable		 1ibgL-3ucqA:
15.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ujz METALLOPROTEASE STCE

(Escherichia
coli) 		PF10462
(Peptidase_M66) 		4 THR A 435
SER A 428
HIS A 412
LEU A 343
 None
 1.09A 1ibgL-3ujzA:
4.5		 1ibgL-3ujzA:
13.64
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.
3vgf MALTO-OLIGOSYLTREHAL
OSE TREHALOHYDROLASE

(Sulfolobus
solfataricus) 		PF00128
(Alpha-amylase)
PF09071
(Alpha-amyl_C) 		4 SER A 396
SER A 533
TYR A 556
LEU A 530
 None
 1.10A 1ibgL-3vgfA:
5.4		 1ibgL-3vgfA:
16.54
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.
3wnp CYCLOISOMALTOOLIGOSA
CCHARIDE
GLUCANOTRANSFERASE

(Bacillus
circulans) 		PF13199
(Glyco_hydro_66)
PF16990
(CBM_35) 		4 THR A 273
SER A 272
SER A 239
ARG A 240
 None
 1.16A 1ibgL-3wnpA:
6.4		 1ibgL-3wnpA:
14.47
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.
3zzi ACETYLGLUTAMATE
KINASE

(Saccharomyces
cerevisiae) 		PF00696
(AA_kinase)
PF04768
(NAT) 		5 THR A  70
SER A  69
HIS A 125
TYR A 129
LEU A 231
 None
 1.43A 1ibgL-3zziA:
undetectable		 1ibgL-3zziA:
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.
4a0u TAIL FIBER PROTEIN

(Escherichia
virus T7) 		PF12604
(gp37_C) 		4 THR A 418
HIS A 411
TYR A 385
LEU A 387
 None
 1.08A 1ibgL-4a0uA:
undetectable		 1ibgL-4a0uA:
20.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ani PROTEIN GRPE

(Geobacillus
kaustophilus) 		PF01025
(GrpE) 		4 SER A 148
ARG A 147
TYR A 146
LEU A 149
 None
 1.05A 1ibgL-4aniA:
undetectable		 1ibgL-4aniA:
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.
4c9m CYTOCHROME P450

(Novosphingobium
aromaticivorans) 		PF00067
(p450) 		4 THR A 187
SER A 401
ARG A 188
LEU A  36
 None
 1.15A 1ibgL-4c9mA:
undetectable		 1ibgL-4c9mA:
18.12
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.
4eb0 LCC

(uncultured
bacterium) 		PF12695
(Abhydrolase_5) 		4 THR A 144
SER A 145
ARG A 143
LEU A 181
 SCN  A 303 (-4.7A)
SCN  A 303 (-2.7A)
None
None
 0.94A 1ibgL-4eb0A:
undetectable		 1ibgL-4eb0A:
22.64
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.
4giw RUN AND SH3
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF02759
(RUN) 		4 THR A  97
SER A  99
SER A  90
LEU A 146
 None
 1.04A 1ibgL-4giwA:
undetectable		 1ibgL-4giwA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4goq HYPOTHETICAL PROTEIN

(Caulobacter
vibrioides) 		PF07372
(DUF1491) 		4 THR A  55
SER A  52
ARG A  61
LEU A  37
 None
None
GOL  A 202 (-4.3A)
None
 0.88A 1ibgL-4goqA:
undetectable		 1ibgL-4goqA:
18.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k6m POLYPROTEIN

(Japanese
encephalitis
virus) 		PF00972
(Flavi_NS5)
PF01728
(FtsJ) 		4 THR A 236
SER A 237
ARG A 208
LEU A  65
 None
 1.14A 1ibgL-4k6mA:
undetectable		 1ibgL-4k6mA:
12.74
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.
4kh7 GLUTATHIONE
S-TRANSFERASE FAMILY
PROTEIN

(Salmonella
enterica) 		PF02798
(GST_N)
PF13410
(GST_C_2) 		4 THR A  11
SER A  10
HIS A 110
LEU A 140
 GSH  A 301 ( 4.4A)
GSH  A 301 (-2.5A)
None
None
 1.15A 1ibgL-4kh7A:
undetectable		 1ibgL-4kh7A:
22.64
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.
4l7t NANU SIALIC ACID
BINDING PROTEIN

(Bacteroides
fragilis) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		4 SER A 378
ARG A 377
TYR A 259
LEU A 380
 None
None
ACT  A 602 (-4.3A)
None
 1.02A 1ibgL-4l7tA:
undetectable		 1ibgL-4l7tA:
18.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l87 SERINE--TRNA LIGASE,
CYTOPLASMIC

(Homo sapiens) 		PF00587
(tRNA-synt_2b)
PF02403
(Seryl_tRNA_N) 		4 SER A 374
SER A 330
TYR A 410
LEU A 290
 None
 1.13A 1ibgL-4l87A:
undetectable		 1ibgL-4l87A:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4lu6 FLAVIN-DEPENDENT
TRYPTOPHAN
HALOGENASE REBH

(Lechevalieria
aerocolonigenes) 		PF04820
(Trp_halogenase) 		4 SER A 358
HIS A 170
SER A  77
LEU A 524
 None
 1.17A 1ibgL-4lu6A:
undetectable		 1ibgL-4lu6A:
18.48
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.
4mbg CAAX
FARNESYLTRANSFERASE
BETA SUBUNIT RAM1

(Aspergillus
fumigatus) 		PF00432
(Prenyltrans) 		4 SER B 463
HIS B 495
TYR B 204
LEU B 208
 None
None
FPP  B 601 ( 4.9A)
None
 1.15A 1ibgL-4mbgB:
undetectable		 1ibgL-4mbgB:
19.18
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.
4mbr SERINE-RICH REPEAT
PROTEIN 2

(Streptococcus
agalactiae) 		PF10425
(SdrG_C_C) 		4 SER A 262
HIS A 529
SER A 395
ARG A 396
 None
 0.99A 1ibgL-4mbrA:
5.8		 1ibgL-4mbrA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4p08 COCAINE ESTERASE

(Rhodococcus sp.
MB1) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		4 HIS A 558
ARG A 556
TYR A 391
LEU A 428
 None
 1.09A 1ibgL-4p08A:
undetectable		 1ibgL-4p08A:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pcg VP1

(Human
polyomavirus 6) 		PF00718
(Polyoma_coat) 		4 SER A 212
SER A 267
ARG A 270
TYR A 266
 None
 1.16A 1ibgL-4pcgA:
undetectable		 1ibgL-4pcgA:
20.49
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.
4tn0 UPF0141 PROTEIN YJDB

(Campylobacter
jejuni) 		PF00884
(Sulfatase) 		4 SER A 327
ARG A 365
TYR A 394
LEU A 398
 None
 1.09A 1ibgL-4tn0A:
undetectable		 1ibgL-4tn0A:
18.07
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.
4u0t ADC-7 BETA-LACTAMASE

(Acinetobacter
baumannii) 		PF00144
(Beta-lactamase) 		4 THR A 313
ARG A 346
TYR A  23
LEU A  19
 PO4  A 401 (-4.0A)
None
None
None
 1.14A 1ibgL-4u0tA:
undetectable		 1ibgL-4u0tA:
22.61
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.
4xgc ORIGIN RECOGNITION
COMPLEX SUBUNIT 5

(Drosophila
melanogaster) 		PF13191
(AAA_16)
PF14630
(ORC5_C) 		4 THR E 373
SER E 372
HIS E 337
LEU E 442
 None
 1.07A 1ibgL-4xgcE:
undetectable		 1ibgL-4xgcE:
17.56
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.
4xnv P2Y PURINOCEPTOR 1,
RUBREDOXIN, P2Y
PURINOCEPTOR 1

(Clostridium
pasteurianum;
Homo sapiens) 		PF00001
(7tm_1)
PF00301
(Rubredoxin) 		4 SER A  87
HIS A 148
SER A 151
ARG A 149
 None
Y01  A1104 (-3.8A)
Y01  A1104 ( 3.9A)
None
 1.08A 1ibgL-4xnvA:
undetectable		 1ibgL-4xnvA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yj1 UNCHARACTERIZED
PROTEIN

(Trypanosoma
brucei) 		PF09818
(ABC_ATPase) 		4 THR A 169
SER A 168
TYR A 143
LEU A 217
 None
 0.89A 1ibgL-4yj1A:
undetectable		 1ibgL-4yj1A:
16.89
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.
4z61 PHYTOSULFOKINE
RECEPTOR 1

(Daucus carota) 		PF00560
(LRR_1)
PF13855
(LRR_8) 		4 THR A 354
SER A 378
SER A 308
TYR A 282
 None
 0.61A 1ibgL-4z61A:
undetectable		 1ibgL-4z61A:
15.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5aca VP1
VP2
VP3

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		4 SER 1 127
HIS 1 123
SER 3 167
TYR 2 100
 None
 0.96A 1ibgL-5aca1:
undetectable		 1ibgL-5aca1:
18.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5b8c PEMBROLIZUMAB LIGHT
CHAIN VARIABLE
REGION (PEMVL)

(Homo sapiens) 		PF07686
(V-set) 		5 THR A  31
SER A  32
SER A  95
ARG A  96
LEU A 100
 None
 0.66A 1ibgL-5b8cA:
22.9		 1ibgL-5b8cA:
42.72
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.
5cwa ANTHRANILATE
SYNTHASE COMPONENT 1

(Mycobacterium
tuberculosis) 		PF00425
(Chorismate_bind)
PF04715
(Anth_synt_I_N) 		4 THR A 216
SER A 215
TYR A 273
LEU A  53
 None
 1.11A 1ibgL-5cwaA:
2.5		 1ibgL-5cwaA:
17.21
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.
5dmy BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		4 THR A 476
SER A 475
ARG A 477
LEU A 378
 None
 1.11A 1ibgL-5dmyA:
6.1		 1ibgL-5dmyA:
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.
5e2h BETA-LACTAMASE

(Mycolicibacterium
smegmatis) 		PF00144
(Beta-lactamase) 		4 THR A 308
ARG A 341
TYR A  17
LEU A  13
 None
 1.07A 1ibgL-5e2hA:
undetectable		 1ibgL-5e2hA:
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.
5ex6 CYTOCHROME P450

(Streptomyces
toyocaensis) 		no annotation 4 THR C  63
SER C  62
HIS C 345
LEU C 348
 None
None
HEM  C 502 (-3.6A)
HEM  C 502 ( 4.3A)
 1.14A 1ibgL-5ex6C:
undetectable		 1ibgL-5ex6C:
17.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ezo C12 FAB

(Plasmodium
falciparum) 		no annotation 4 SER A 201
ARG A 135
TYR A 144
LEU A  93
 None
 1.16A 1ibgL-5ezoA:
undetectable		 1ibgL-5ezoA:
18.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jh8 PROBABLE CHITINASE

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		4 THR A  84
SER A  85
TYR A 159
LEU A 164
 None
 1.10A 1ibgL-5jh8A:
undetectable		 1ibgL-5jh8A:
20.99
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.
5mhf MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE

(Mus musculus) 		no annotation 4 SER A 589
HIS A 594
ARG A 562
TYR A 582
 NAG  A 904 ( 4.7A)
None
None
None
 1.11A 1ibgL-5mhfA:
2.0		 1ibgL-5mhfA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nju GENOME POLYPROTEIN

(Zika virus) 		no annotation 4 THR A 236
SER A 237
ARG A 208
LEU A  65
 None
 1.07A 1ibgL-5njuA:
undetectable		 1ibgL-5njuA:
19.62
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.
5usc PREPHENATE
DEHYDROGENASE

(Bacillus
anthracis) 		PF02153
(PDH) 		4 THR A 194
HIS A 190
TYR A 155
LEU A 157
 None
 1.07A 1ibgL-5uscA:
undetectable		 1ibgL-5uscA:
22.59
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.
5whr INDOLEAMINE
2,3-DIOXYGENASE 1

(Homo sapiens) 		no annotation 5 THR A 395
SER A 398
SER A 341
ARG A 343
LEU A 211
 None
None
None
HEM  A 501 (-3.9A)
None
 1.44A 1ibgL-5whrA:
undetectable		 1ibgL-5whrA:
16.26
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.
5whr INDOLEAMINE
2,3-DIOXYGENASE 1

(Homo sapiens) 		no annotation 4 THR A 395
SER A 398
SER A 344
ARG A 343
 None
None
None
HEM  A 501 (-3.9A)
 1.17A 1ibgL-5whrA:
undetectable		 1ibgL-5whrA:
16.26
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.
5wiv D(4) DOPAMINE
RECEPTOR, SOLUBLE
CYTOCHROME B562
CHIMERA

(Escherichia
coli;
Homo sapiens) 		no annotation 4 SER A  71
SER A 130
ARG A 133
LEU A 211
 OLA  A1207 (-3.2A)
None
PO4  A1205 (-2.5A)
None
 1.13A 1ibgL-5wivA:
undetectable		 1ibgL-5wivA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5wzr ALPHA-N-ACETYLGALACT
OSAMINIDASE

(Bifidobacterium
bifidum) 		PF11308
(Glyco_hydro_129) 		4 THR A 572
ARG A 531
TYR A 626
LEU A 543
 None
 1.11A 1ibgL-5wzrA:
undetectable		 1ibgL-5wzrA:
15.20
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.
5xfa NAD-REDUCING
HYDROGENASE

(Hydrogenophilus
thermoluteolus) 		PF00374
(NiFeSe_Hases)
PF01058
(Oxidored_q6) 		4 THR C  18
HIS C  28
TYR D 130
LEU D 126
 None
 1.03A 1ibgL-5xfaC:
undetectable		 1ibgL-5xfaC:
20.42
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.
5xya -

(-) 		no annotation 4 THR A 407
SER A 406
TYR A1526
LEU A1525
 None
 0.99A 1ibgL-5xyaA:
2.9		 1ibgL-5xyaA:
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.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194) 		4 THR C 481
SER C 480
TYR C 565
LEU C 564
 None
 1.13A 1ibgL-5y3rC:
undetectable		 1ibgL-5y3rC:
4.44
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.
5zc3 -

(-) 		no annotation 4 THR B 432
SER B 431
TYR B 414
LEU B 410
 None
 0.87A 1ibgL-5zc3B:
undetectable		 1ibgL-5zc3B:
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.
5znp SHORT LIFE FAMILY
PROTEIN

(Populus
trichocarpa) 		no annotation 4 SER A  50
ARG A  58
TYR A  14
LEU A  11
 None
 1.11A 1ibgL-5znpA:
undetectable		 1ibgL-5znpA:
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.
6avh GH3.15 ACYL ACID
AMIDO SYNTHETASE

(Arabidopsis
thaliana) 		no annotation 4 THR A 557
SER A 560
ARG A 559
LEU A 432
 None
 1.15A 1ibgL-6avhA:
undetectable		 1ibgL-6avhA:
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.
6cvz E3 UBIQUITIN-PROTEIN
LIGASE RFWD3

(Homo sapiens) 		no annotation 4 THR A 662
SER A 665
ARG A 664
LEU A 651
 None
 1.11A 1ibgL-6cvzA:
undetectable		 1ibgL-6cvzA:
17.43
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.
6dch SCOE PROTEIN

(Streptomyces
coeruleorubidus) 		no annotation 4 HIS A 225
SER A 292
ARG A 291
LEU A 293
 None
 1.10A 1ibgL-6dchA:
undetectable		 1ibgL-6dchA:
17.39
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.
6dkh L-IDONATE
5-DEHYDROGENASE
(NAD(P)(+))

(Escherichia
coli) 		no annotation 4 THR A 293
SER A 294
HIS A 160
SER A 289
 None
 1.17A 1ibgL-6dkhA:
undetectable		 1ibgL-6dkhA:
21.02
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6ejg SINGLE CHAIN FV
FRAGMENT

(Mus musculus) 		no annotation 4 THR C  69
SER C  70
SER C 133
ARG C 134
 None
 0.75A 1ibgL-6ejgC:
22.7		 1ibgL-6ejgC:
91.14
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.
6fsh OXYB PROTEIN

(Actinoplanes
teichomyceticus) 		no annotation 4 THR A  63
SER A  62
HIS A 345
LEU A 348
 None
None
HEM  A 401 (-3.5A)
HEM  A 401 ( 4.5A)
 0.99A 1ibgL-6fshA:
undetectable		 1ibgL-6fshA:
16.82