SIMILAR PATTERNS OF AMINO ACIDS FOR 5KIR_A_RCXA601_1

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism
Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bh6 SUBTILISIN DY

(Bacillus
licheniformis)
PF00082
(Peptidase_S8)
5 ALA A 152
VAL A  68
GLY A  70
ALA A  69
LEU A  90
1BH  A 300 ( 3.7A)
None
None
None
None
1.01A 5kirA-1bh6A:
undetectable
5kirA-1bh6A:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1bkh MUCONATE LACTONIZING
ENZYME


(Pseudomonas
putida)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
5 VAL A  36
LEU A  37
ALA A  76
GLY A  47
LEU A 362
None
1.03A 5kirA-1bkhA:
0.0
5kirA-1bkhA:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1c3l SUBTILISIN-CARLSBERG

(Bacillus
licheniformis)
PF00082
(Peptidase_S8)
5 ALA A 152
VAL A  68
GLY A  70
ALA A  69
LEU A  90
XE  A 281 ( 3.9A)
None
None
None
None
1.01A 5kirA-1c3lA:
undetectable
5kirA-1c3lA:
18.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1ebv PROSTAGLANDIN H2
SYNTHASE


(Ovis aries)
PF00008
(EGF)
PF03098
(An_peroxidase)
9 HIS A  90
GLN A 192
VAL A 349
LEU A 352
TYR A 355
TRP A 387
GLY A 526
ALA A 527
LEU A 531
None
None
SCL  A 700 ( 4.6A)
SCL  A 700 ( 4.8A)
SCL  A 700 (-4.3A)
None
SCL  A 700 ( 4.0A)
SCL  A 700 (-2.9A)
OAS  A 530 (-4.1A)
0.30A 5kirA-1ebvA:
58.4
5kirA-1ebvA:
63.70
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.
1gwc GLUTATHIONE
S-TRANSFERASE TSI-1


(Aegilops
tauschii)
PF00043
(GST_C)
PF02798
(GST_N)
5 VAL A 168
TRP A 195
ALA A 204
VAL A 163
ALA A 164
None
1.08A 5kirA-1gwcA:
1.6
5kirA-1gwcA:
17.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jio CYTOCHROME P450
107A1


(Saccharopolyspora
erythraea)
PF00067
(p450)
5 VAL A 152
ALA A 126
VAL A 363
GLY A 361
LEU A 356
None
None
None
None
HEM  A 410 ( 4.4A)
1.04A 5kirA-1jioA:
undetectable
5kirA-1jioA:
20.72
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.
1jy1 TYROSYL-DNA
PHOSPHODIESTERASE


(Homo sapiens)
PF06087
(Tyr-DNA_phospho)
5 VAL A 227
TYR A 537
ALA A 332
SER A 334
LEU A 335
None
0.93A 5kirA-1jy1A:
0.0
5kirA-1jy1A:
21.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE


(Acinetobacter
sp.)
PF00111
(Fer2)
PF00175
(NAD_binding_1)
PF00970
(FAD_binding_6)
5 VAL A 241
TYR A 305
ALA A 328
SER A 237
LEU A 232
None
1.08A 5kirA-1krhA:
0.0
5kirA-1krhA:
19.02
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.
1n61 CARBON MONOXIDE
DEHYDROGENASE MEDIUM
CHAIN


(Oligotropha
carboxidovorans)
PF00941
(FAD_binding_5)
PF03450
(CO_deh_flav_C)
5 LEU C  51
ALA C  46
GLY C  33
ALA C  32
LEU C  54
None
None
FAD  C3932 (-3.4A)
FAD  C3932 (-3.5A)
None
1.04A 5kirA-1n61C:
0.0
5kirA-1n61C:
19.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1o8c YHDH

(Escherichia
coli)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 VAL A 265
ALA A 243
VAL A 159
GLY A 128
ALA A 131
None
NDP  A1325 (-3.5A)
NDP  A1325 (-4.0A)
None
None
1.06A 5kirA-1o8cA:
undetectable
5kirA-1o8cA:
21.47
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2


(Synechocystis
sp. PCC 6803)
PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central)
5 VAL A 642
ALA A 638
VAL A 625
GLY A 623
ALA A 621
None
0.94A 5kirA-1ofeA:
undetectable
5kirA-1ofeA:
17.18
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.
1qhg ATP-DEPENDENT
HELICASE PCRA


(Geobacillus
stearothermophilus)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
6 VAL A  40
LEU A  41
ALA A  68
GLY A 250
ALA A  31
LEU A 282
None
1.09A 5kirA-1qhgA:
undetectable
5kirA-1qhgA:
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.
1qhh PROTEIN (PCRA
(SUBUNIT))


(Geobacillus
stearothermophilus)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
6 VAL A  40
LEU A  41
ALA A  68
GLY B 250
ALA A  31
LEU B 282
None
1.10A 5kirA-1qhhA:
undetectable
5kirA-1qhhA:
13.92
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.
1rrv GLYCOSYLTRANSFERASE
GTFD


(Amycolatopsis
orientalis)
PF03033
(Glyco_transf_28)
5 VAL A  46
ALA A  38
VAL A  14
GLY A  17
LEU A 219
VAL  A  46 ( 0.6A)
ALA  A  38 ( 0.0A)
VAL  A  14 ( 0.6A)
GLY  A  17 ( 0.0A)
LEU  A 219 ( 0.6A)
0.89A 5kirA-1rrvA:
undetectable
5kirA-1rrvA:
20.54
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.
1sc6 D-3-PHOSPHOGLYCERATE
DEHYDROGENASE


(Escherichia
coli)
PF00389
(2-Hacid_dh)
PF01842
(ACT)
PF02826
(2-Hacid_dh_C)
5 LEU A  65
ALA A  93
VAL A 101
GLY A  80
ALA A  81
None
1.02A 5kirA-1sc6A:
undetectable
5kirA-1sc6A:
21.62
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.
1sez PROTOPORPHYRINOGEN
OXIDASE,
MITOCHONDRIAL


(Nicotiana
tabacum)
PF01593
(Amino_oxidase)
5 VAL A 332
VAL A 173
GLY A 175
ALA A 174
LEU A 369
None
None
OMN  A 601 (-3.6A)
None
OMN  A 601 (-3.7A)
1.06A 5kirA-1sezA:
undetectable
5kirA-1sezA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1uaa PROTEIN
(ATP-DEPENDENT DNA
HELICASE REP.)


(Escherichia
coli)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
5 VAL A  31
ALA A  59
GLY A 241
ALA A  22
LEU A 273
None
0.98A 5kirA-1uaaA:
undetectable
5kirA-1uaaA:
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.
1uz4 MAN5A

(Cellvibrio
mixtus)
PF00150
(Cellulase)
5 VAL A 127
LEU A  79
ALA A 377
ALA A  50
LEU A 113
None
0.84A 5kirA-1uz4A:
undetectable
5kirA-1uz4A:
21.45
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.
2ark FLAVODOXIN

(Aquifex
aeolicus)
PF00258
(Flavodoxin_1)
5 VAL A   6
LEU A  36
GLY A  25
ALA A  26
LEU A 158
None
0.99A 5kirA-2arkA:
undetectable
5kirA-2arkA:
14.26
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.
2cb1 O-ACETYL HOMOSERINE
SULFHYDRYLASE


(Thermus
thermophilus)
PF01053
(Cys_Met_Meta_PP)
5 VAL A 174
TRP A 223
ALA A  71
ALA A  87
LEU A  88
None
0.95A 5kirA-2cb1A:
undetectable
5kirA-2cb1A:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2d7s RNA-DEPENDENT RNA
POLYMERASE


(Foot-and-mouth
disease virus)
PF00680
(RdRP_1)
5 LEU A 442
ALA A 410
VAL A 427
GLY A 429
ALA A 428
None
1.08A 5kirA-2d7sA:
undetectable
5kirA-2d7sA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gko SUBTILISIN
MICROBIAL SERINE
PROTEINASES


(Bacillus
subtilis)
PF00082
(Peptidase_S8)
5 ALA A 165
VAL A  75
GLY A  77
ALA A  76
LEU A  98
PMS  A 601 ( 3.8A)
None
None
None
None
0.92A 5kirA-2gkoA:
undetectable
5kirA-2gkoA:
20.11
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.
2i34 ACID PHOSPHATASE

(Bacillus
anthracis)
PF03767
(Acid_phosphat_B)
5 VAL A  70
ALA A  98
GLY A 142
ALA A 143
LEU A 110
None
1.08A 5kirA-2i34A:
undetectable
5kirA-2i34A:
16.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2k4k GENERAL STRESS
PROTEIN 13


(Bacillus
subtilis)
PF00575
(S1)
5 ALA A  78
VAL A  35
GLY A  22
ALA A  23
LEU A  18
None
0.89A 5kirA-2k4kA:
undetectable
5kirA-2k4kA:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pjr PROTEIN (HELICASE
PCRA)


(Geobacillus
stearothermophilus)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
6 VAL A  40
LEU A  41
ALA A  68
GLY A 250
ALA A  31
LEU A 282
None
1.10A 5kirA-2pjrA:
undetectable
5kirA-2pjrA:
21.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pwz MALATE DEHYDROGENASE

(Escherichia
coli)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
6 VAL A 102
LEU A 101
ALA A  66
VAL A  73
GLY A 115
LEU A 143
None
1.41A 5kirA-2pwzA:
undetectable
5kirA-2pwzA:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wdw PUTATIVE HEXOSE
OXIDASE


(Nonomuraea
gerenzanensis)
PF01565
(FAD_binding_4)
PF08031
(BBE)
6 VAL A 176
LEU A 179
ALA A 198
GLY A 216
ALA A 416
LEU A 417
None
1.49A 5kirA-2wdwA:
undetectable
5kirA-2wdwA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xn8 PUTATIVE CYTOCHROME
P450 125


(Mycobacterium
tuberculosis)
PF00067
(p450)
5 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
1.05A 5kirA-2xn8A:
undetectable
5kirA-2xn8A:
19.96
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.
2yr5 PRO-ENZYME OF
L-PHENYLALANINE
OXIDASE


(Pseudomonas sp.
P-501)
no annotation 5 ALA A 236
VAL A 214
GLY A 211
ALA A 210
LEU A 206
None
0.90A 5kirA-2yr5A:
undetectable
5kirA-2yr5A:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3a71 EXO-ARABINANASE

(Penicillium
chrysogenum)
no annotation 5 LEU A 108
ALA A 340
GLY A 127
ALA A 126
LEU A 141
None
0.98A 5kirA-3a71A:
undetectable
5kirA-3a71A:
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.
3aam ENDONUCLEASE IV

(Thermus
thermophilus)
PF01261
(AP_endonuc_2)
5 VAL A 107
VAL A 117
GLY A 120
ALA A 121
LEU A 136
None
1.08A 5kirA-3aamA:
undetectable
5kirA-3aamA:
18.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
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)
6 HIS A 919
VAL A 633
LEU A 630
TRP A 581
ALA A 552
LEU A 550
None
1.35A 5kirA-3bgaA:
0.5
5kirA-3bgaA:
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.
3d43 SPHERICASE

(Lysinibacillus
sphaericus)
PF00082
(Peptidase_S8)
5 ALA A 166
VAL A  75
GLY A  77
ALA A  76
LEU A  99
None
1.00A 5kirA-3d43A:
undetectable
5kirA-3d43A:
18.64
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.
3dec BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron)
PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981)
6 HIS A 895
VAL A 609
LEU A 606
TRP A 557
ALA A 528
LEU A 526
None
1.38A 5kirA-3decA:
undetectable
5kirA-3decA:
20.14
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.
3dyj TALIN-1

(Mus musculus)
no annotation 6 ALA A2023
VAL A2062
GLY A2065
ALA A2066
SER A2068
LEU A2069
None
1.27A 5kirA-3dyjA:
undetectable
5kirA-3dyjA:
22.71
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.
3fyq CG6831-PA (TALIN)

(Drosophila
melanogaster)
no annotation 5 ALA A2032
VAL A2071
ALA A2075
SER A2077
LEU A2078
None
1.07A 5kirA-3fyqA:
undetectable
5kirA-3fyqA:
13.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gdn R-OXYNITRILE LYASE
ISOENZYME 1


(Prunus dulcis)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 TYR A 457
ALA A 495
VAL A 113
GLY A 112
ALA A 111
HBX  A 530 (-4.3A)
None
FAD  A 522 (-3.7A)
FAD  A 522 (-3.9A)
FAD  A 522 ( 3.0A)
0.93A 5kirA-3gdnA:
undetectable
5kirA-3gdnA:
22.41
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.
3h6e CARBOHYDRATE KINASE,
FGGY


(Novosphingobium
aromaticivorans)
PF00370
(FGGY_N)
5 ALA A 325
VAL A 400
ALA A 404
SER A 407
LEU A 408
None
0.79A 5kirA-3h6eA:
undetectable
5kirA-3h6eA:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hz6 XYLULOKINASE

(Chromobacterium
violaceum)
PF00370
(FGGY_N)
PF02782
(FGGY_C)
5 VAL A 339
LEU A 379
ALA A 330
VAL A 381
GLY A 384
None
0.95A 5kirA-3hz6A:
undetectable
5kirA-3hz6A:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3lfu DNA HELICASE II

(Escherichia
coli)
PF00580
(UvrD-helicase)
PF13361
(UvrD_C)
6 VAL A  38
LEU A  39
ALA A  66
GLY A 247
ALA A  29
LEU A 279
None
1.10A 5kirA-3lfuA:
undetectable
5kirA-3lfuA:
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.
3ls1 SLL1638 PROTEIN

(Synechocystis
sp. PCC 6803)
PF05757
(PsbQ)
5 ALA A  51
GLY A  88
ALA A  90
SER A  92
LEU A  93
None
1.09A 5kirA-3ls1A:
undetectable
5kirA-3ls1A:
15.11
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.
3mpi GLUTARYL-COA
DEHYDROGENASE


(Desulfococcus
multivorans)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
5 HIS A 244
LEU A 102
VAL A  55
GLY A  53
SER A 118
None
0.98A 5kirA-3mpiA:
undetectable
5kirA-3mpiA:
20.56
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.
3nbm PTS SYSTEM,
LACTOSE-SPECIFIC
IIBC COMPONENTS


(Streptococcus
pneumoniae)
PF02302
(PTS_IIB)
5 VAL A 512
LEU A 508
TYR A 538
VAL A 460
GLY A 491
None
1.08A 5kirA-3nbmA:
undetectable
5kirA-3nbmA:
11.90
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.
3nx4 PUTATIVE
OXIDOREDUCTASE


(Salmonella
enterica)
PF00107
(ADH_zinc_N)
PF08240
(ADH_N)
5 VAL A 265
ALA A 243
VAL A 159
GLY A 128
ALA A 131
None
NAP  A 330 (-3.5A)
NAP  A 330 (-3.8A)
None
None
1.08A 5kirA-3nx4A:
undetectable
5kirA-3nx4A:
19.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ocd SOXA

(Starkeya
novella)
no annotation 5 LEU A  90
VAL A 140
ALA A 144
SER A 147
LEU A 268
None
0.94A 5kirA-3ocdA:
undetectable
5kirA-3ocdA:
19.38
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.
3red HYDROXYNITRILE LYASE

(Prunus mume)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 TYR A 458
ALA A 496
VAL A 113
GLY A 112
ALA A 111
None
None
FAD  A 773 (-3.7A)
FAD  A 773 (-3.9A)
FAD  A 773 (-3.0A)
0.98A 5kirA-3redA:
undetectable
5kirA-3redA:
21.85
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.
3s99 BASIC MEMBRANE
LIPOPROTEIN


(Brucella
abortus)
PF02608
(Bmp)
5 VAL A 291
LEU A 294
ALA A 300
VAL A 132
GLY A 134
None
0.97A 5kirA-3s99A:
undetectable
5kirA-3s99A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3slk POLYKETIDE SYNTHASE
EXTENDER MODULE 2


(Saccharopolyspora
spinosa)
PF08240
(ADH_N)
PF08659
(KR)
PF13602
(ADH_zinc_N_2)
5 LEU A 663
ALA A 658
VAL A 622
GLY A 624
LEU A 629
None
0.87A 5kirA-3slkA:
undetectable
5kirA-3slkA:
21.23
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.
3ti7 BASIC EXTRACELLULAR
SUBTILISIN-LIKE
PROTEASE BPRV


(Dichelobacter
nodosus)
PF00082
(Peptidase_S8)
5 VAL A  37
ALA A 204
VAL A 109
GLY A 111
ALA A 110
None
1.09A 5kirA-3ti7A:
undetectable
5kirA-3ti7A:
22.01
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.
3wdb PROBABLE
ATP-DEPENDENT CLP
PROTEASE ATP-BINDING
SUBUNIT


(Mycobacterium
tuberculosis)
PF02861
(Clp_N)
5 LEU A 110
ALA A  95
ALA A  45
SER A  48
LEU A  49
None
0.79A 5kirA-3wdbA:
0.8
5kirA-3wdbA:
14.13
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.
4etz PELD

(Pseudomonas
aeruginosa)
PF13492
(GAF_3)
PF16963
(PelD_GGDEF)
5 GLN A 194
VAL A 188
LEU A 191
ALA A 300
LEU A 267
None
1.06A 5kirA-4etzA:
undetectable
5kirA-4etzA:
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.
4f3m BH0337 PROTEIN

(Bacillus
halodurans)
PF09704
(Cas_Cas5d)
5 VAL A 144
LEU A   9
GLY A  40
ALA A  42
SER A  44
None
0.94A 5kirA-4f3mA:
undetectable
5kirA-4f3mA:
18.43
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 14


(Thermus
thermophilus)
PF00361
(Proton_antipo_M)
5 LEU N 290
ALA N 401
ALA N 329
SER N 332
LEU N 333
None
1.09A 5kirA-4heaN:
undetectable
5kirA-4heaN:
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.
4j9u TRK SYSTEM POTASSIUM
UPTAKE PROTEIN TRKH


(Vibrio
parahaemolyticus)
PF02386
(TrkH)
5 VAL A  79
GLY A  81
ALA A  83
SER A  85
LEU A  86
None
0.92A 5kirA-4j9uA:
3.1
5kirA-4j9uA:
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.
4jcd MAJOR CAPSID PROTEIN
VP1


(Human
polyomavirus 2)
PF00718
(Polyoma_coat)
5 ALA A 255
VAL A 111
GLY A 113
SER A 116
LEU A 117
None
1.02A 5kirA-4jcdA:
undetectable
5kirA-4jcdA:
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.
4k0e HEAVY METAL CATION
TRICOMPONENT EFFLUX
PUMP ZNEA(CZCA-LIKE)


(Cupriavidus
metallidurans)
PF00873
(ACR_tran)
5 VAL A 923
LEU A 926
VAL A 961
ALA A 965
LEU A 997
None
1.06A 5kirA-4k0eA:
0.6
5kirA-4k0eA:
19.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k3j HEPATOCYTE GROWTH
FACTOR


(Homo sapiens)
PF00089
(Trypsin)
5 VAL A 687
ALA A 659
GLY A 675
SER A 522
LEU A 530
None
0.89A 5kirA-4k3jA:
undetectable
5kirA-4k3jA:
18.60
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.
4kg7 PEPTIDASE S8 AND
S53, SUBTILISIN,
KEXIN, SEDOLISIN


(Mycolicibacterium
smegmatis)
PF00082
(Peptidase_S8)
5 VAL A  91
ALA A 235
VAL A 130
GLY A 132
ALA A 131
None
1.07A 5kirA-4kg7A:
undetectable
5kirA-4kg7A:
21.87
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.
4ky0 PROTON/GLUTAMATE
SYMPORTER, SDF
FAMILY


(Thermococcus
kodakarensis)
PF00375
(SDF)
5 VAL A 153
LEU A 154
GLY A 309
ALA A 310
LEU A 284
None
1.07A 5kirA-4ky0A:
undetectable
5kirA-4ky0A:
22.86
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.
4mzd NISIN LEADER
PEPTIDE-PROCESSING
SERINE PROTEASE NISP


(Lactococcus
lactis)
PF00082
(Peptidase_S8)
5 VAL A 255
ALA A 404
VAL A 310
GLY A 312
ALA A 311
None
1.09A 5kirA-4mzdA:
undetectable
5kirA-4mzdA:
21.33
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.
4nng 30S RIBOSOMAL
PROTEIN S1


(Mycobacterium
tuberculosis)
PF00575
(S1)
5 ALA A 365
VAL A 321
GLY A 308
ALA A 309
LEU A 304
None
1.02A 5kirA-4nngA:
undetectable
5kirA-4nngA:
13.76
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.
4o1m ENOYL-ACYL CARRIER
REDUCTASE


(Toxoplasma
gondii)
PF13561
(adh_short_C2)
5 LEU A 286
VAL A 266
GLY A 268
ALA A 270
LEU A 274
None
0.81A 5kirA-4o1mA:
undetectable
5kirA-4o1mA:
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.
4owt INTEGRATOR COMPLEX
SUBUNIT 3


(Homo sapiens)
PF10189
(Ints3)
5 VAL A 149
ALA A 112
VAL A 157
GLY A 159
ALA A 160
None
1.06A 5kirA-4owtA:
undetectable
5kirA-4owtA:
19.50
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.
4oye 425AA LONG
HYPOTHETICAL PROTON
GLUTAMATE SYMPORT
PROTEIN


(Pyrococcus
horikoshii)
PF00375
(SDF)
5 VAL A 151
LEU A 152
GLY A 306
ALA A 307
LEU A 282
None
1.07A 5kirA-4oyeA:
undetectable
5kirA-4oyeA:
21.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pe3 TRAP DICARBOXYLATE
TRANSPORTER-DCTP
SUBUNIT


(Rhodobacter
sphaeroides)
PF03480
(DctP)
5 GLN A 139
LEU A 355
TRP A 334
ALA A 135
GLY A 328
None
1.09A 5kirA-4pe3A:
undetectable
5kirA-4pe3A:
19.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2


(Mus musculus)
PF00008
(EGF)
PF03098
(An_peroxidase)
12 HIS A  90
GLN A 193
VAL A 350
LEU A 353
TYR A 356
TRP A 388
ALA A 517
VAL A 524
GLY A 527
ALA A 528
SER A 531
LEU A 532
None
None
IBP  A 601 (-4.3A)
IBP  A 601 ( 4.7A)
IBP  A 601 (-4.5A)
None
None
IBP  A 601 ( 4.0A)
IBP  A 601 (-3.9A)
IBP  A 601 (-3.4A)
IBP  A 601 ( 3.3A)
IBP  A 601 ( 4.9A)
0.25A 5kirA-4ph9A:
62.4
5kirA-4ph9A:
87.84
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.
4pot VP1

(Human
polyomavirus 9)
PF00718
(Polyoma_coat)
5 ALA A 267
VAL A 122
GLY A 124
SER A 127
LEU A 128
None
EDO  A 403 (-4.4A)
None
None
None
1.06A 5kirA-4potA:
undetectable
5kirA-4potA:
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.
4psd CARBOHYDRATE
ESTERASE FAMILY 5


(Trichoderma
reesei)
PF01083
(Cutinase)
5 HIS A 249
VAL A 159
LEU A 158
GLY A 118
LEU A 108
None
1.01A 5kirA-4psdA:
undetectable
5kirA-4psdA:
17.90
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.
4q60 PROLINE RACEMASE

(Burkholderia
multivorans)
PF05544
(Pro_racemase)
5 ALA A  74
VAL A  97
GLY A  95
SER A  10
LEU A 291
None
1.09A 5kirA-4q60A:
undetectable
5kirA-4q60A:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r86 RND FAMILY
AMINOGLYCOSIDE/MULTI
DRUG EFFLUX PUMP


(Salmonella
enterica)
PF00873
(ACR_tran)
5 GLN A 176
VAL A 169
GLY A 229
ALA A 232
LEU A 154
None
0.98A 5kirA-4r86A:
undetectable
5kirA-4r86A:
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.
4rnc ESTERASE

(Rhodococcus sp.
ECU1013)
PF12697
(Abhydrolase_6)
5 HIS A 253
VAL A 219
LEU A 124
GLY A 137
ALA A 232
None
0.99A 5kirA-4rncA:
undetectable
5kirA-4rncA:
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.
4rt6 HEME/HEMOPEXIN-BINDI
NG PROTEIN


(Haemophilus
influenzae)
PF05860
(Haemagg_act)
5 GLN A 254
GLY A 356
ALA A 357
SER A 360
LEU A 361
None
0.83A 5kirA-4rt6A:
undetectable
5kirA-4rt6A:
20.46
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.
4tqv ALGM1
ALGM2


(Sphingomonas
sp.)
PF00528
(BPD_transp_1)
5 LEU B 232
TYR B 213
VAL B 237
GLY A 150
ALA A 149
None
1.04A 5kirA-4tqvB:
undetectable
5kirA-4tqvB:
17.60
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.
4us5 LUCIFERASE-LIKE
MONOOXYGENASE


(Streptomyces
bottropensis)
PF00296
(Bac_luciferase)
5 VAL A 309
ALA A  28
VAL A  41
GLY A  74
ALA A  42
NA  A1340 (-3.7A)
None
None
None
None
0.94A 5kirA-4us5A:
0.0
5kirA-4us5A:
18.64
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.
4zqb NADP-DEPENDENT
DEHYDROGENASE


(Rhodobacter
sphaeroides)
PF02826
(2-Hacid_dh_C)
5 VAL A 176
ALA A 180
GLY A 149
ALA A 150
LEU A 154
None
0.80A 5kirA-4zqbA:
undetectable
5kirA-4zqbA:
20.56
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.
5a4j FORMATE--TETRAHYDROF
OLATE LIGASE


(Tepidanaerobacter
acetatoxydans)
PF01268
(FTHFS)
5 VAL A 327
ALA A 331
GLY A 308
ALA A 309
LEU A 313
None
1.06A 5kirA-5a4jA:
undetectable
5kirA-5a4jA:
23.31
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.
5azs OUTER MEMBRANE
PROTEIN OPRJ


(Pseudomonas
aeruginosa)
PF02321
(OEP)
5 ALA A 345
GLY A 286
ALA A 287
SER A 129
LEU A 130
None
1.02A 5kirA-5azsA:
undetectable
5kirA-5azsA:
20.34
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.
5dot CARBAMOYL-PHOSPHATE
SYNTHASE [AMMONIA],
MITOCHONDRIAL


(Homo sapiens)
PF00117
(GATase)
PF00988
(CPSase_sm_chain)
PF02142
(MGS)
PF02786
(CPSase_L_D2)
PF02787
(CPSase_L_D3)
5 VAL A 425
ALA A 513
GLY A 535
ALA A 742
LEU A 743
None
0.96A 5kirA-5dotA:
undetectable
5kirA-5dotA:
16.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5et1 ESPIN

(Mus musculus)
PF12796
(Ank_2)
PF13637
(Ank_4)
PF13857
(Ank_5)
5 VAL A 107
LEU A 108
ALA A 132
GLY A 127
LEU A  90
None
None
GOL  A 401 (-3.7A)
GOL  A 402 ( 4.4A)
None
0.99A 5kirA-5et1A:
undetectable
5kirA-5et1A:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fbz ENZYME SUBTILASE
SUBHAL FROM BACILLUS
HALMAPALUS


(Bacillus
halmapalus)
PF00082
(Peptidase_S8)
PF04151
(PPC)
5 ALA A 158
VAL A  72
GLY A  74
ALA A  73
LEU A  91
None
None
5VV  A   1 ( 4.8A)
None
None
0.93A 5kirA-5fbzA:
undetectable
5kirA-5fbzA:
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.
5ffn ENZYME SUBTILASE
SUBTY FROM BACILLUS
SP. TY145


(Bacillus sp.
(in: Bacteria))
PF00082
(Peptidase_S8)
5 ALA A 167
VAL A  76
GLY A  78
ALA A  77
LEU A 100
None
0.98A 5kirA-5ffnA:
undetectable
5kirA-5ffnA:
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.
5ffn ENZYME SUBTILASE
SUBTY FROM BACILLUS
SP. TY145


(Bacillus sp.
(in: Bacteria))
PF00082
(Peptidase_S8)
5 VAL A  31
ALA A 167
VAL A  76
GLY A  78
ALA A  77
None
1.06A 5kirA-5ffnA:
undetectable
5kirA-5ffnA:
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.
5h5z MHC CLASS I ANTIGEN

(Ctenopharyngodon
idella)
no annotation 5 GLN A 152
TYR A  97
VAL A  65
GLY A  68
ALA A  69
None
1.09A 5kirA-5h5zA:
undetectable
5kirA-5h5zA:
9.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2


(Homo sapiens)
PF00008
(EGF)
PF03098
(An_peroxidase)
11 HIS A  90
GLN A 192
VAL A 349
LEU A 352
TYR A 355
TRP A 387
ALA A 516
VAL A 523
ALA A 527
SER A 530
LEU A 531
None
None
ID8  A 601 (-3.9A)
ID8  A 601 (-4.1A)
ID8  A 601 (-3.8A)
COH  A 602 (-4.5A)
None
ID8  A 601 (-3.6A)
ID8  A 601 (-3.5A)
ID8  A 601 (-2.7A)
ID8  A 601 (-3.5A)
0.68A 5kirA-5ikrA:
63.0
5kirA-5ikrA:
99.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ikr PROSTAGLANDIN G/H
SYNTHASE 2


(Homo sapiens)
PF00008
(EGF)
PF03098
(An_peroxidase)
11 HIS A  90
GLN A 192
VAL A 349
LEU A 352
TYR A 355
TRP A 387
ALA A 516
VAL A 523
GLY A 526
ALA A 527
LEU A 531
None
None
ID8  A 601 (-3.9A)
ID8  A 601 (-4.1A)
ID8  A 601 (-3.8A)
COH  A 602 (-4.5A)
None
ID8  A 601 (-3.6A)
ID8  A 601 (-3.5A)
ID8  A 601 (-3.5A)
ID8  A 601 (-3.5A)
0.45A 5kirA-5ikrA:
63.0
5kirA-5ikrA:
99.82
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.
5kei 2,3-DIHYDROXYBENZOAT
E-AMP LIGASE


(Mycolicibacterium
smegmatis)
PF00501
(AMP-binding)
PF13193
(AMP-binding_C)
5 LEU A 266
ALA A 106
GLY A 273
ALA A 274
LEU A 243
None
1.06A 5kirA-5keiA:
0.6
5kirA-5keiA:
23.37
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.
5m32 PROTEASOME SUBUNIT
BETA TYPE-2


(Homo sapiens)
PF00227
(Proteasome)
5 LEU J   4
TYR J 117
GLY J 135
ALA J 136
LEU J 140
None
1.02A 5kirA-5m32J:
undetectable
5kirA-5m32J:
16.57
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.
5nug CYTOPLASMIC DYNEIN 1
HEAVY CHAIN 1


(Homo sapiens)
PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9)
5 VAL A4309
LEU A4312
TRP A4320
GLY A4152
ALA A4155
None
1.03A 5kirA-5nugA:
undetectable
5kirA-5nugA:
7.70
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.
5o0s GLUCOSYLCERAMIDASE

(Thermoanaerobacterium
xylanolyticum)
PF04685
(DUF608)
PF12215
(Glyco_hydr_116N)
PF17168
(DUF5127)
5 LEU A 411
TYR A 412
ALA A 406
GLY A 457
LEU A 439
None
0.93A 5kirA-5o0sA:
undetectable
5kirA-5o0sA:
21.05
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.
5u2o J30 CCH

(Thermobacillus
composti)
no annotation 5 VAL A 400
LEU A 401
GLY A 416
ALA A 418
LEU A 421
None
1.08A 5kirA-5u2oA:
undetectable
5kirA-5u2oA:
9.32
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.
5u39 UDP-3-O-ACYL-N-ACETY
LGLUCOSAMINE
DEACETYLASE


(Pseudomonas
aeruginosa)
PF03331
(LpxC)
6 LEU A  86
ALA A 117
GLY A 108
ALA A 107
SER A 186
LEU A 240
None
1.29A 5kirA-5u39A:
undetectable
5kirA-5u39A:
20.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uld TRANSPORTER, NADC
FAMILY


(Vibrio cholerae)
PF00939
(Na_sulph_symp)
5 LEU A 270
VAL A 295
GLY A 298
ALA A 299
LEU A 303
None
0.79A 5kirA-5uldA:
undetectable
5kirA-5uldA:
20.46
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.
5uxb MACROLIDE
2'-PHOSPHOTRANSFERAS
E MPHH


(Brachybacterium
faecium)
PF01636
(APH)
5 VAL A 127
LEU A 130
TRP A 215
ALA A 138
GLY A 195
None
1.09A 5kirA-5uxbA:
undetectable
5kirA-5uxbA:
19.54
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.
5vwm UDP-3-O-ACYL-N-ACETY
LGLUCOSAMINE
DEACETYLASE


(Pseudomonas
aeruginosa)
PF03331
(LpxC)
5 LEU A  86
GLY A 108
ALA A 107
SER A 186
LEU A 240
None
EDO  A 405 (-3.4A)
None
EDO  A 405 (-2.8A)
None
1.07A 5kirA-5vwmA:
undetectable
5kirA-5vwmA:
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.
5wqk SULFURTRANSFERASE

(Mus musculus)
PF00581
(Rhodanese)
5 LEU A 232
VAL A 257
GLY A 260
ALA A 261
SER A 264
None
1.09A 5kirA-5wqkA:
undetectable
5kirA-5wqkA:
18.68
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.
5y09 PROTEASE DO-LIKE 9

(Arabidopsis
thaliana)
no annotation 5 ALA A 565
VAL A 540
GLY A 538
ALA A 537
LEU A 586
None
1.08A 5kirA-5y09A:
undetectable
5kirA-5y09A:
21.05
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.
5yl7 PSEUDOALTEROMONAS
ARCTICA PAMC 21717


(Pseudoalteromonas
arctica)
no annotation 5 VAL A 181
ALA A 343
VAL A 248
GLY A 250
ALA A 249
None
1.07A 5kirA-5yl7A:
undetectable
5kirA-5yl7A:
7.86
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.
5yvs ALCOHOL
DEHYDROGENASE


(candidate
divison MSBL1
archaeon
SCGC-AAA259E19)
no annotation 5 ALA A 160
VAL A  77
GLY A  80
ALA A  81
LEU A  85
None
0.77A 5kirA-5yvsA:
undetectable
5kirA-5yvsA:
9.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5zl9 CHITINASE AB

(Serratia
marcescens)
no annotation 5 VAL A 160
ALA A 520
GLY A 559
ALA A 560
SER A 156
None
GOL  A 701 (-3.4A)
None
None
None
1.02A 5kirA-5zl9A:
undetectable
5kirA-5zl9A:
9.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ez8 HUNTINGTIN

(Homo sapiens)
no annotation 5 VAL A2782
ALA A2745
GLY A2777
ALA A2778
LEU A2767
None
1.09A 5kirA-6ez8A:
undetectable
5kirA-6ez8A:
7.45