SIMILAR PATTERNS OF AMINO ACIDS FOR 4KLR_B_CHDB503

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.
1jqg CARBOXYPEPTIDASE A

(Helicoverpa
armigera) 		PF00246
(Peptidase_M14)
PF02244
(Propep_M14) 		4 LEU A 212
SER A 255
VAL A 224
GLY A 223
 None
 0.98A 4klrB-1jqgA:
2.7		 4klrB-1jqgA:
21.70
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.
1k7h ALKALINE PHOSPHATASE

(Pandalus
borealis) 		PF00245
(Alk_phosphatase) 		4 LEU A 352
SER A  64
GLY A 311
MET A 333
 None
 0.97A 4klrB-1k7hA:
undetectable		 4klrB-1k7hA:
19.10
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.
1ofe FERREDOXIN-DEPENDENT
GLUTAMATE SYNTHASE 2

(Synechocystis
sp. PCC 6803) 		PF00310
(GATase_2)
PF01493
(GXGXG)
PF01645
(Glu_synthase)
PF04898
(Glu_syn_central) 		5 PRO A1496
SER A1498
VAL A1420
GLY A1421
MET A1424
 None
 1.22A 4klrB-1ofeA:
3.5		 4klrB-1ofeA:
12.81
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.
1pqz MCMV M144

(Murid
betaherpesvirus
1) 		PF07654
(C1-set) 		4 LEU A 235
PRO A 145
SER A 144
VAL A 149
 None
 1.01A 4klrB-1pqzA:
undetectable		 4klrB-1pqzA:
20.22
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.
1tqy ACTINORHODIN
POLYKETIDE PUTATIVE
BETA-KETOACYL
SYNTHASE 2

(Streptomyces
coelicolor) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 PRO B  90
VAL B 182
GLY B  99
MET B 150
 None
 0.85A 4klrB-1tqyB:
undetectable		 4klrB-1tqyB:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ua4 ADP-DEPENDENT
GLUCOKINASE

(Pyrococcus
furiosus) 		PF04587
(ADP_PFK_GK) 		5 LEU A 145
ARG A 109
SER A 445
VAL A 436
GLY A 437
 None
None
None
BGC  A2457 ( 4.9A)
BGC  A2457 ( 4.0A)
 1.22A 4klrB-1ua4A:
2.3		 4klrB-1ua4A:
20.93
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.
1uag UDP-N-ACETYLMURAMOYL
-L-ALANINE/:D-GLUTAM
ATE LIGASE

(Escherichia
coli) 		PF02875
(Mur_ligase_C)
PF08245
(Mur_ligase_M) 		4 LEU A 147
ARG A 100
VAL A  92
GLY A  93
 None
 0.99A 4klrB-1uagA:
2.7		 4klrB-1uagA:
21.20
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.
1ukf AVIRULENCE PROTEIN
AVRPPH3

(Pseudomonas
savastanoi) 		PF03543
(Peptidase_C58) 		4 LEU A 202
ARG A 265
SER A 235
GLY A 197
 None
 0.99A 4klrB-1ukfA:
undetectable		 4klrB-1ukfA:
18.70
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.
1w0m TRIOSEPHOSPHATE
ISOMERASE

(Thermoproteus
tenax) 		PF00121
(TIM)
PF05690
(ThiG) 		4 LEU A 194
ARG A 154
PRO A 142
GLY A 181
 None
None
None
PO4  A1226 (-3.6A)
 0.95A 4klrB-1w0mA:
2.3		 4klrB-1w0mA:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yqd SINAPYL ALCOHOL
DEHYDROGENASE

(Populus
tremuloides) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 LEU A 340
SER A 216
VAL A 198
GLY A 196
 NAP  A 500 ( 4.8A)
NAP  A 500 (-2.6A)
None
None
 1.00A 4klrB-1yqdA:
3.1		 4klrB-1yqdA:
21.25
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.
1z3z DIALKYLGLYCINE
DECARBOXYLASE

(Burkholderia
cepacia) 		PF00202
(Aminotran_3) 		4 PRO A  86
SER A  84
VAL A 317
GLY A 314
 None
 1.02A 4klrB-1z3zA:
2.6		 4klrB-1z3zA:
22.13
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.
1zcz BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Thermotoga
maritima) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		4 PRO A 227
SER A 226
VAL A 367
GLY A 368
 None
 0.97A 4klrB-1zczA:
undetectable		 4klrB-1zczA:
22.74
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.
1zuw GLUTAMATE RACEMASE 1

(Bacillus
subtilis) 		PF01177
(Asp_Glu_race) 		4 LEU A 226
PRO A  92
VAL A   8
GLY A   7
 None
 0.90A 4klrB-1zuwA:
2.8		 4klrB-1zuwA:
21.28
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.
2ag5 DEHYDROGENASE/REDUCT
ASE (SDR FAMILY)
MEMBER 6

(Homo sapiens) 		PF13561
(adh_short_C2) 		5 LEU A 185
ARG A 210
PRO A 177
SER A 133
GLY A 241
 NAD  A2001 (-4.4A)
None
NAD  A2001 (-3.9A)
NAD  A2001 ( 4.0A)
None
 1.46A 4klrB-2ag5A:
3.1		 4klrB-2ag5A:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2b5m DAMAGE-SPECIFIC DNA
BINDING PROTEIN 1

(Homo sapiens) 		PF03178
(CPSF_A)
PF10433
(MMS1_N) 		4 LEU A 736
SER A 766
VAL A 866
GLY A 846
 None
 0.99A 4klrB-2b5mA:
undetectable		 4klrB-2b5mA:
16.24
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.
2bbz VIRAL CASP8 AND
FADD-LIKE APOPTOSIS
REGULATOR

(Molluscum
contagiosum
virus) 		PF01335
(DED) 		4 LEU A 130
SER A  26
VAL A 103
GLY A 104
 None
 0.91A 4klrB-2bbzA:
undetectable		 4klrB-2bbzA:
21.69
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.
2cg9 ATP-DEPENDENT
MOLECULAR CHAPERONE
HSP82

(Saccharomyces
cerevisiae) 		PF00183
(HSP90)
PF02518
(HATPase_c) 		4 LEU A 374
SER A  39
VAL A 122
GLY A 123
 None
None
ATP  A1678 (-3.8A)
ATP  A1678 (-3.3A)
 0.97A 4klrB-2cg9A:
undetectable		 4klrB-2cg9A:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2cx1 HYPOTHETICAL PROTEIN
APE0525

(Aeropyrum
pernix) 		PF01472
(PUA)
PF09183
(DUF1947) 		4 LEU A  67
ARG A  74
VAL A 143
GLY A 142
 None
 0.88A 4klrB-2cx1A:
undetectable		 4klrB-2cx1A:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ggj N-ACYLAMINO ACID
RACEMASE

(Deinococcus
radiodurans) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 ARG A 328
SER A 312
VAL A 141
GLY A 140
 None
 0.97A 4klrB-2ggjA:
2.6		 4klrB-2ggjA:
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.
2hfs MEVALONATE KINASE,
PUTATIVE

(Leishmania
major) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C) 		4 LEU A 164
SER A 281
GLY A 243
MET A 246
 None
 0.87A 4klrB-2hfsA:
2.2		 4klrB-2hfsA:
22.02
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.
2l1n UNCHARACTERIZED
PROTEIN

(Synechococcus
elongatus) 		PF08853
(DUF1823) 		4 LEU A 111
PRO A  59
VAL A  34
GLY A  32
 None
 0.98A 4klrB-2l1nA:
undetectable		 4klrB-2l1nA:
17.57
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.
2nn6 POLYMYOSITIS/SCLEROD
ERMA AUTOANTIGEN 1

(Homo sapiens) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		4 LEU A  98
PRO A 209
GLY A 219
MET A 217
 None
 0.89A 4klrB-2nn6A:
undetectable		 4klrB-2nn6A:
23.00
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.
2p9w MAL S 1 ALLERGENIC
PROTEIN

(Malassezia
sympodialis) 		no annotation 4 LEU A 131
SER A  78
GLY A  89
MET A  87
 None
 0.81A 4klrB-2p9wA:
undetectable		 4klrB-2p9wA:
19.80
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.
2qty POLY(ADP-RIBOSE)
GLYCOHYDROLASE ARH3

(Mus musculus) 		PF03747
(ADP_ribosyl_GH) 		4 LEU A  36
ARG A 287
PRO A 320
SER A 322
 None
 0.83A 4klrB-2qtyA:
undetectable		 4klrB-2qtyA:
21.88
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.
2r79 PERIPLASMIC BINDING
PROTEIN

(Pseudomonas
aeruginosa) 		PF01497
(Peripla_BP_2) 		4 LEU A  50
PRO A 271
VAL A 266
GLY A 267
 None
None
HEM  A 500 ( 4.8A)
None
 0.82A 4klrB-2r79A:
2.2		 4klrB-2r79A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v14 KINESIN-LIKE MOTOR
PROTEIN C20ORF23

(Homo sapiens) 		PF00787
(PX) 		4 SER A1293
LYS A1287
VAL A1288
GLY A1289
 None
 0.96A 4klrB-2v14A:
undetectable		 4klrB-2v14A:
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.
2vut NITROGEN METABOLITE
REPRESSION REGULATOR
NMRA
NITROGEN REGULATORY
PROTEIN AREA

(Aspergillus
nidulans;
Aspergillus
nidulans) 		PF05368
(NmrA)
PF00320
(GATA) 		4 LEU A  47
PRO I 709
VAL A 196
GLY A 197
 None
 0.91A 4klrB-2vutA:
2.7		 4klrB-2vutA:
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.
2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE

(Rhodospirillum
rubrum) 		PF03747
(ADP_ribosyl_GH) 		4 LEU A  66
ARG A 281
VAL A 261
GLY A  12
 None
 0.93A 4klrB-2wocA:
undetectable		 4klrB-2wocA:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wuq BETA-LACTAMASE
REGULATORY PROTEIN
BLAB

(Streptomyces
cacaoi) 		PF13354
(Beta-lactamase2) 		4 LEU A 138
SER A  23
VAL A 267
GLY A 266
 None
 0.97A 4klrB-2wuqA:
undetectable		 4klrB-2wuqA:
22.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2x40 BETA-GLUCOSIDASE

(Thermotoga
neapolitana) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		5 LEU A 116
PRO A  26
SER A  34
VAL A  21
GLY A  22
 GOL  A1726 ( 4.8A)
None
None
None
None
 1.44A 4klrB-2x40A:
undetectable		 4klrB-2x40A:
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.
2x6k PHOSPHOTIDYLINOSITOL
3 KINASE 59F

(Drosophila
melanogaster) 		PF00454
(PI3_PI4_kinase)
PF00613
(PI3Ka) 		4 LEU A 808
PRO A 837
VAL A 803
GLY A 804
 None
 0.96A 4klrB-2x6kA:
undetectable		 4klrB-2x6kA:
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.
2xes PROTEIN PAT1 HOMOLOG
1

(Homo sapiens) 		PF09770
(PAT1) 		4 LEU A 644
SER A 738
VAL A 679
GLY A 685
 None
 0.91A 4klrB-2xesA:
undetectable		 4klrB-2xesA:
22.34
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.
2xn1 ALPHA-GALACTOSIDASE

(Lactobacillus
acidophilus) 		PF02065
(Melibiase)
PF16874
(Glyco_hydro_36C)
PF16875
(Glyco_hydro_36N) 		4 LEU A 644
SER A 567
VAL A 635
GLY A 639
 None
 1.00A 4klrB-2xn1A:
undetectable		 4klrB-2xn1A:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xsg CCMAN5

(Cellulosimicrobium
cellulans) 		PF07971
(Glyco_hydro_92) 		4 ARG A  42
PRO A 402
SER A 350
GLY A  74
 None
 0.98A 4klrB-2xsgA:
undetectable		 4klrB-2xsgA:
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.
2yvs GLYCOLATE OXIDASE
SUBUNIT GLCE

(Thermus
thermophilus) 		no annotation 4 ARG A  76
SER A  97
VAL A 108
GLY A  64
 None
 0.96A 4klrB-2yvsA:
undetectable		 4klrB-2yvsA:
18.65
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3aqi FERROCHELATASE

(Homo sapiens) 		PF00762
(Ferrochelatase) 		4 LEU A 101
PRO A 266
SER A 268
GLY A 306
 CHD  A   3 ( 4.9A)
CHD  A   2 ( 4.5A)
CHD  A   2 ( 4.4A)
CHD  A   2 ( 3.8A)
 0.73A 4klrB-3aqiA:
52.9		 4klrB-3aqiA:
99.16
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.
3ayf NITRIC OXIDE
REDUCTASE

(Geobacillus
stearothermophilus) 		PF00115
(COX1) 		4 LEU A 587
SER A 552
VAL A 628
GLY A 627
 None
None
None
HEM  A 802 ( 4.8A)
 0.95A 4klrB-3ayfA:
undetectable		 4klrB-3ayfA:
17.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bh1 UPF0371 PROTEIN
DIP2346

(Corynebacterium
diphtheriae) 		PF08903
(DUF1846) 		5 LEU A 190
PRO A 276
SER A 275
VAL A 285
GLY A 284
 None
 1.40A 4klrB-3bh1A:
undetectable		 4klrB-3bh1A:
22.43
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.
3cux MALATE SYNTHASE

(Bacillus
anthracis) 		PF01274
(Malate_synthase) 		4 LEU A 281
ARG A 295
VAL A 420
GLY A 421
 None
 1.02A 4klrB-3cuxA:
undetectable		 4klrB-3cuxA:
23.35
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.
3dhv D-ALANINE-POLY(PHOSP
HORIBITOL) LIGASE

(Bacillus cereus) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 LEU A 227
SER A 484
GLY A 491
MET A 487
 None
 0.88A 4klrB-3dhvA:
2.2		 4klrB-3dhvA:
21.56
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.
3e3x BIPA

(Vibrio
parahaemolyticus) 		PF00679
(EFG_C) 		4 LEU A  90
ARG A  70
PRO A 123
SER A 169
 None
None
None
EDO  A1001 ( 4.5A)
 1.01A 4klrB-3e3xA:
undetectable		 4klrB-3e3xA:
23.12
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.
3eo7 PUTATIVE
NITROREDUCTASE

(Trichormus
variabilis) 		PF00881
(Nitroreductase) 		4 LEU A 192
ARG A 453
PRO A 107
GLY A 229
 None
 1.02A 4klrB-3eo7A:
undetectable		 4klrB-3eo7A:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3epf PROTEIN VP1
PROTEIN VP2

(Enterovirus C;
Enterovirus C) 		PF00073
(Rhv)
PF00073
(Rhv) 		4 LEU 2 231
PRO 1 273
VAL 1 277
GLY 2 183
 None
 1.01A 4klrB-3epf2:
undetectable		 4klrB-3epf2:
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.
3g79 NDP-N-ACETYL-D-GALAC
TOSAMINURONIC ACID
DEHYDROGENASE

(Methanosarcina
mazei) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		4 LEU A 119
ARG A 326
VAL A 289
GLY A 290
 None
 0.95A 4klrB-3g79A:
2.0		 4klrB-3g79A:
23.18
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.
3hhd FATTY ACID SYNTHASE

(Homo sapiens) 		PF00109
(ketoacyl-synt)
PF00698
(Acyl_transf_1)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc) 		4 LEU A  26
PRO A 332
SER A 225
GLY A 294
 None
 0.94A 4klrB-3hhdA:
undetectable		 4klrB-3hhdA:
17.02
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.
3hja GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Borreliella
burgdorferi) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 PRO A 124
SER A 152
VAL A  96
GLY A  95
 None
SO4  A 336 (-3.2A)
NAD  A 337 ( 4.9A)
NAD  A 337 (-3.2A)
 1.02A 4klrB-3hjaA:
3.4		 4klrB-3hjaA:
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.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT BETA

(Moorella
thermoacetica) 		PF03063
(Prismane) 		4 PRO A  13
VAL A 604
GLY A 605
MET A 636
 None
 0.99A 4klrB-3i04A:
4.0		 4klrB-3i04A:
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.
3iau THREONINE DEAMINASE

(Solanum
lycopersicum) 		PF00291
(PALP) 		4 LEU A 107
PRO A  53
VAL A 191
GLY A 190
 None
 0.91A 4klrB-3iauA:
undetectable		 4klrB-3iauA:
22.67
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.
3ioy SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR

(Novosphingobium
aromaticivorans) 		PF00106
(adh_short) 		4 PRO A 193
SER A 256
LYS A 167
VAL A 170
 None
 0.98A 4klrB-3ioyA:
3.3		 4klrB-3ioyA:
20.41
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.
3j4s FTSZ/TUBULIN-RELATED
PROTEIN

(Bacillus
thuringiensis) 		PF00091
(Tubulin) 		4 LEU A 270
PRO A 161
VAL A  27
GLY A  26
 None
 0.95A 4klrB-3j4sA:
2.2		 4klrB-3j4sA:
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.
3k6e CBS DOMAIN PROTEIN

(Streptococcus
pneumoniae) 		PF00571
(CBS) 		4 LEU A  40
SER A 113
VAL A  58
GLY A  59
 None
 0.78A 4klrB-3k6eA:
undetectable		 4klrB-3k6eA:
18.70
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.
3m6x RRNA METHYLASE

(Thermus
thermophilus) 		PF01189
(Methyltr_RsmB-F)
PF17125
(Methyltr_RsmF_N)
PF17126
(RsmF_methylt_CI) 		4 LEU A 106
PRO A 307
SER A 305
GLY A 351
 None
 0.99A 4klrB-3m6xA:
undetectable		 4klrB-3m6xA:
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.
3o47 ADP-RIBOSYLATION
FACTOR
GTPASE-ACTIVATING
PROTEIN 1,
ADP-RIBOSYLATION
FACTOR 1

(Homo sapiens) 		PF00025
(Arf)
PF01412
(ArfGap) 		4 LEU A 275
SER A 224
VAL A 153
GLY A 154
 None
 1.01A 4klrB-3o47A:
2.9		 4klrB-3o47A:
21.88
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.
3ogr BETA-GALACTOSIDASE

(Trichoderma
reesei) 		PF01301
(Glyco_hydro_35)
PF10435
(BetaGal_dom2)
PF13363
(BetaGal_dom3)
PF13364
(BetaGal_dom4_5) 		4 LEU A  53
PRO A 245
SER A 289
GLY A  40
 None
 1.02A 4klrB-3ogrA:
undetectable		 4klrB-3ogrA:
16.50
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.
3ooq AMIDOHYDROLASE

(Thermotoga
maritima) 		PF01979
(Amidohydro_1) 		4 LEU A 108
ARG A 135
SER A  64
VAL A 144
 None
 1.02A 4klrB-3ooqA:
undetectable		 4klrB-3ooqA:
21.70
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.
3out GLUTAMATE RACEMASE

(Francisella
tularensis) 		PF01177
(Asp_Glu_race) 		4 LEU A 222
PRO A  93
VAL A   9
GLY A   8
 None
 0.81A 4klrB-3outA:
4.9		 4klrB-3outA:
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.
3ov3 CURCUMIN SYNTHASE

(Curcuma longa) 		PF00195
(Chal_sti_synt_N)
PF02797
(Chal_sti_synt_C) 		4 LEU A 127
SER A 339
VAL A  99
GLY A 134
 None
 1.01A 4klrB-3ov3A:
undetectable		 4klrB-3ov3A:
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.
3q8n 4-AMINOBUTYRATE
TRANSAMINASE

(Mycolicibacterium
smegmatis) 		PF00202
(Aminotran_3) 		4 PRO A 425
VAL A  57
GLY A  56
MET A 429
 None
 0.99A 4klrB-3q8nA:
undetectable		 4klrB-3q8nA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qe7 URACIL PERMEASE

(Escherichia
coli) 		PF00860
(Xan_ur_permease) 		4 LEU A 236
PRO A 284
SER A  72
GLY A 271
 None
None
URA  A 430 (-4.4A)
None
 1.01A 4klrB-3qe7A:
undetectable		 4klrB-3qe7A:
23.99
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.
3qvm OLEI00960

(Oleispira
antarctica) 		PF00561
(Abhydrolase_1) 		4 LEU A 171
SER A 105
VAL A 142
GLY A 143
 None
 0.95A 4klrB-3qvmA:
2.0		 4klrB-3qvmA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rjl 1-PYRROLINE-5-CARBOX
YLATE DEHYDROGENASE

(Bacillus
licheniformis) 		PF00171
(Aldedh) 		4 LEU A 120
PRO A 180
VAL A 194
GLY A 191
 None
 0.95A 4klrB-3rjlA:
2.8		 4klrB-3rjlA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sto SERINE PROTEASE
INHIBITOR

(Schistosoma
haematobium) 		PF00079
(Serpin) 		4 LEU A 335
SER A  56
VAL A 189
GLY A 120
 None
 1.01A 4klrB-3stoA:
undetectable		 4klrB-3stoA:
22.99
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.
3t2y SULFIDE-QUINONE
REDUCTASE, PUTATIVE

(Acidithiobacillus
ferrooxidans) 		PF07992
(Pyr_redox_2) 		4 LEU A 109
PRO A 163
VAL A  48
GLY A  49
 None
FAD  A 500 (-4.4A)
None
None
 0.98A 4klrB-3t2yA:
undetectable		 4klrB-3t2yA:
23.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3thw DNA MISMATCH REPAIR
PROTEIN MSH3

(Homo sapiens) 		PF00488
(MutS_V)
PF01624
(MutS_I)
PF05188
(MutS_II)
PF05192
(MutS_III) 		4 LEU B 486
SER B 520
VAL B 384
GLY B 383
 None
 0.95A 4klrB-3thwB:
undetectable		 4klrB-3thwB:
16.90
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.
3tjz ADP-RIBOSYLATION
FACTOR 1

(Saccharomyces
cerevisiae) 		PF00025
(Arf) 		4 LEU A 145
SER A  94
VAL A  23
GLY A  24
 None
 0.96A 4klrB-3tjzA:
4.3		 4klrB-3tjzA:
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.
3unv ADMH

(Pantoea
agglomerans) 		PF00221
(Lyase_aromatic) 		4 LEU A 174
SER A 460
VAL A 230
GLY A 229
 None
KWS  A 168 ( 4.5A)
None
None
 0.86A 4klrB-3unvA:
undetectable		 4klrB-3unvA:
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.
3vb9 UNCHARACTERIZED
PROTEIN VPA0735

(Vibrio
parahaemolyticus) 		PF06742
(DUF1214)
PF06863
(DUF1254) 		4 LEU A 266
SER A  68
VAL A 293
GLY A 294
 None
 0.91A 4klrB-3vb9A:
undetectable		 4klrB-3vb9A:
21.15
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.
3w5n PUTATIVE
RHAMNOSIDASE

(Streptomyces
avermitilis) 		PF05592
(Bac_rhamnosid)
PF08531
(Bac_rhamnosid_N)
PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		4 PRO A 479
SER A 595
VAL A 338
GLY A 339
 None
 1.00A 4klrB-3w5nA:
undetectable		 4klrB-3w5nA:
15.16
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.
4asi ACETYL-COA
CARBOXYLASE 1

(Homo sapiens) 		PF01039
(Carboxyl_trans) 		4 LEU A1949
PRO A2114
VAL A2022
GLY A2021
 None
 0.94A 4klrB-4asiA:
undetectable		 4klrB-4asiA:
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.
4d72 GLYCOSIDE HYDROLASE

(Streptococcus
pneumoniae) 		PF08306
(Glyco_hydro_98M)
PF08307
(Glyco_hydro_98C) 		4 LEU A 692
PRO A 438
VAL A 718
GLY A 717
 None
 0.99A 4klrB-4d72A:
undetectable		 4klrB-4d72A:
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.
4di4 TATP(T) (TP0957)

(Treponema
pallidum) 		PF03480
(DctP) 		4 LEU B 168
SER B  91
VAL B  78
GLY B 229
 None
 1.01A 4klrB-4di4B:
undetectable		 4klrB-4di4B:
21.52
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.
4eut SERINE/THREONINE-PRO
TEIN KINASE TBK1

(Homo sapiens) 		PF00069
(Pkinase) 		4 LEU A 277
PRO A 220
SER A 247
GLY A 217
 None
 1.01A 4klrB-4eutA:
undetectable		 4klrB-4eutA:
22.72
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.
4f32 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Burkholderia
vietnamiensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 LEU A  27
PRO A 231
SER A 229
GLY A 391
 None
 1.00A 4klrB-4f32A:
undetectable		 4klrB-4f32A:
22.20
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.
4f32 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Burkholderia
vietnamiensis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		4 PRO A 231
SER A 342
VAL A 319
GLY A 320
 None
None
N32  A 501 (-3.7A)
N32  A 501 (-3.3A)
 0.98A 4klrB-4f32A:
undetectable		 4klrB-4f32A:
22.20
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.
4i2w PROTEIN UNC-45

(Caenorhabditis
elegans) 		PF11701
(UNC45-central) 		4 LEU A 421
SER A 469
VAL A 480
GLY A 481
 None
 0.99A 4klrB-4i2wA:
undetectable		 4klrB-4i2wA:
16.01
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.
4ifa EXTRACELLULAR
PROTEIN CONTAINING A
SCP DOMAIN

(Bacillus
anthracis) 		PF00188
(CAP)
PF14504
(CAP_assoc_N) 		4 LEU A 328
SER A 259
VAL A 304
GLY A 303
 None
 1.00A 4klrB-4ifaA:
undetectable		 4klrB-4ifaA:
23.83
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.
4j05 PHOSPHATE
TRANSPORTER

(Serendipita
indica) 		PF00083
(Sugar_tr) 		4 LEU A  49
SER A 153
VAL A  87
GLY A  88
 None
 1.01A 4klrB-4j05A:
undetectable		 4klrB-4j05A:
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.
4jn7 ENOLASE

(Agrobacterium
tumefaciens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 LEU A  48
PRO A  78
SER A  74
GLY A 270
 None
 0.97A 4klrB-4jn7A:
undetectable		 4klrB-4jn7A:
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.
4jqs HYPOTHETICAL PROTEIN

(Bacteroides
uniformis) 		PF06283
(ThuA) 		4 LEU A 138
VAL A  89
GLY A 115
MET A 110
 None
 0.88A 4klrB-4jqsA:
undetectable		 4klrB-4jqsA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k2b NTD BIOSYNTHESIS
OPERON PROTEIN NTDA

(Bacillus
subtilis) 		PF01041
(DegT_DnrJ_EryC1) 		4 LEU A 114
SER A 311
VAL A 251
GLY A 250
 None
None
None
LLP  A 247 ( 4.8A)
 1.00A 4klrB-4k2bA:
undetectable		 4klrB-4k2bA:
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.
4myd 2-SUCCINYL-6-HYDROXY
-2,4-CYCLOHEXADIENE-
1-CARBOXYLATE
SYNTHASE

(Escherichia
coli) 		PF12697
(Abhydrolase_6) 		4 LEU A  72
PRO A  48
SER A  53
GLY A  88
 None
 0.88A 4klrB-4mydA:
3.5		 4klrB-4mydA:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nes UDP-N-ACETYLGLUCOSAM
INE 2-EPIMERASE

(Methanocaldococcus
jannaschii) 		PF02350
(Epimerase_2) 		4 LEU A 179
SER A  17
VAL A 269
GLY A 270
 None
None
UDP  A 401 (-3.8A)
UDP  A 401 ( 4.7A)
 0.82A 4klrB-4nesA:
2.8		 4klrB-4nesA:
19.75
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.
4of8 IRREGULAR CHIASM
C-ROUGHEST PROTEIN

(Drosophila
melanogaster) 		PF07679
(I-set)
PF08205
(C2-set_2) 		4 LEU A  67
PRO A  34
SER A 121
GLY A 125
 None
None
None
GOL  A 302 (-3.6A)
 0.92A 4klrB-4of8A:
undetectable		 4klrB-4of8A:
21.93
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.
4pmj PUTATIVE
OXIDOREDUCTASE

(Sinorhizobium
meliloti) 		PF00248
(Aldo_ket_red) 		4 PRO A 238
SER A 236
GLY A  43
MET A  48
 NAP  A 301 (-4.7A)
None
None
None
 0.72A 4klrB-4pmjA:
undetectable		 4klrB-4pmjA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q3k MGS-M1

(unidentified) 		PF00326
(Peptidase_S9)
PF07859
(Abhydrolase_3) 		4 LEU A 118
ARG A  81
VAL A  12
GLY A  13
 None
 0.83A 4klrB-4q3kA:
3.8		 4klrB-4q3kA:
22.40
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.
4qus ACETYLTRANSFERASE
YPEA

(Escherichia
coli) 		PF00583
(Acetyltransf_1) 		4 LEU A  24
PRO A  76
VAL A  54
GLY A  56
 None
 0.98A 4klrB-4qusA:
undetectable		 4klrB-4qusA:
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.
4tx8 PROBABLE CHITINASE A

(Chromobacterium
violaceum) 		PF00704
(Glyco_hydro_18) 		4 LEU A 211
SER A 178
VAL A 154
GLY A 190
 None
 0.91A 4klrB-4tx8A:
undetectable		 4klrB-4tx8A:
20.76
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.
4ulx LPBCA-L89K
THIOREDOXIN

(synthetic
construct) 		PF00085
(Thioredoxin) 		4 PRO A  94
LYS A  89
VAL A  90
GLY A  91
 None
 0.82A 4klrB-4ulxA:
3.1		 4klrB-4ulxA:
14.44
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.
4wa0 POSSIBLE ADHESIN

(Caldicellulosiruptor
kronotskyensis) 		no annotation 4 LEU A 524
ARG A 513
VAL A 475
GLY A 476
 None
None
MG  A 601 (-4.8A)
MG  A 601 ( 4.4A)
 0.91A 4klrB-4wa0A:
undetectable		 4klrB-4wa0A:
19.61
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.
4xgt FRQ-INTERACTING RNA
HELICASE

(Neurospora
crassa) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF08148
(DSHCT)
PF13234
(rRNA_proc-arch) 		4 LEU A 753
ARG A 735
PRO A 719
GLY A 771
 None
 0.99A 4klrB-4xgtA:
2.5		 4klrB-4xgtA:
16.60
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.
4ye5 PEPTIDOGLYCAN
SYNTHETASE
PENICILLIN-BINDING
PROTEIN 3

(Bifidobacterium
adolescentis) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		4 LEU A 251
PRO A 411
VAL A 197
GLY A 196
 None
 0.92A 4klrB-4ye5A:
undetectable		 4klrB-4ye5A:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yxc FLAGELLAR ASSEMBLY
PROTEIN H,ENDOLYSIN

(Escherichia
virus T4;
Salmonella
enterica) 		PF00959
(Phage_lysozyme) 		4 SER A  59
LYS A  37
VAL A  78
GLY A  77
 None
 0.94A 4klrB-4yxcA:
undetectable		 4klrB-4yxcA:
19.83
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.
5af7 ACYL-COA
DEHYDROGENASE

(Advenella
mimigardefordensis) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		5 LEU A 372
PRO A 314
SER A 309
VAL A  87
GLY A 249
 None
 1.22A 4klrB-5af7A:
undetectable		 4klrB-5af7A:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ec3 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Homo sapiens) 		PF00903
(Glyoxalase)
PF13669
(Glyoxalase_4) 		4 LEU A 367
PRO A 239
SER A 226
GLY A 358
 LEU  A 367 ( 0.6A)
PRO  A 239 ( 1.1A)
SER  A 226 ( 0.0A)
GLY  A 358 ( 0.0A)
 0.94A 4klrB-5ec3A:
undetectable		 4klrB-5ec3A:
22.20
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.
5g52 VP1
VP3

(Deformed wing
virus;
Deformed wing
virus) 		PF08762
(CRPV_capsid)
PF00073
(Rhv) 		4 LEU C 248
SER C 112
VAL A 237
GLY A 238
 None
 0.89A 4klrB-5g52C:
undetectable		 4klrB-5g52C:
20.92
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.
5hj7 GLUTAMATE RACEMASE

(Mycobacterium
tuberculosis) 		PF01177
(Asp_Glu_race) 		4 LEU A 226
PRO A  93
VAL A  10
GLY A   9
 None
 0.93A 4klrB-5hj7A:
4.5		 4klrB-5hj7A:
20.47
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.
5hm7 BUTYROPHILIN
SUBFAMILY 3 MEMBER
A1

(Homo sapiens) 		PF00622
(SPRY)
PF13765
(PRY) 		4 LEU A 423
SER A 286
VAL A 432
GLY A 431
 None
 0.97A 4klrB-5hm7A:
undetectable		 4klrB-5hm7A:
20.48
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.
5jem INTERFERON
REGULATORY FACTOR 3
CREB-BINDING PROTEIN

(Homo sapiens;
Homo sapiens) 		PF10401
(IRF-3)
PF09030
(Creb_binding)
PF11707
(Npa1) 		4 LEU C2096
SER A 336
VAL A 381
GLY A 382
 None
 1.00A 4klrB-5jemC:
undetectable		 4klrB-5jemC:
11.04
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.
5jif HEMAGGLUTININ-ESTERA
SE

(Murine
coronavirus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		4 LEU A  40
ARG A  45
VAL A 107
GLY A 106
 None
 0.93A 4klrB-5jifA:
undetectable		 4klrB-5jifA:
22.68
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.
5jjq AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Streptomyces
sp. ML694-90F3) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		5 LEU A  85
ARG A  52
PRO A 234
SER A 209
VAL A  44
 None
 1.43A 4klrB-5jjqA:
3.3		 4klrB-5jjqA:
24.47