SIMILAR PATTERNS OF AMINO ACIDS FOR 2KOT_A_ANWA99

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.
1bf2 ISOAMYLASE

(Pseudomonas
amyloderamosa) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		4 VAL A 708
PHE A 721
THR A 720
ARG A 563
 None
 1.26A 2kotA-1bf2A:
undetectable		 2kotA-1bf2A:
8.31
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.
1cw0 PROTEIN (DNA
MISMATCH
ENDONUCLEASE)

(Escherichia
coli) 		PF03852
(Vsr) 		4 VAL A 114
THR A  63
ARG A 120
LYS A 124
 None
MG  A 203 (-4.7A)
None
None
 1.08A 2kotA-1cw0A:
undetectable		 2kotA-1cw0A:
22.15
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.
1igo FAMILY 11 XYLANASE

(Bacillus
subtilis) 		PF00457
(Glyco_hydro_11) 		4 VAL A 116
THR A 115
PHE A 114
THR A 113
 None
 1.22A 2kotA-1igoA:
undetectable		 2kotA-1igoA:
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.
1iiw SLR1257 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF00497
(SBP_bac_3) 		4 MET A 208
VAL A 216
PHE A 220
THR A 221
 None
 1.15A 2kotA-1iiwA:
0.0		 2kotA-1iiwA:
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.
1jiu DNA
BETA-GLUCOSYLTRANSFE
RASE

(Escherichia
virus T4) 		PF09198
(T4-Gluco-transf) 		4 VAL A 200
PHE A 204
THR A 206
LYS A 230
 None
 1.14A 2kotA-1jiuA:
undetectable		 2kotA-1jiuA:
14.99
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.
1l8w VLSE1

(Borreliella
burgdorferi) 		PF00921
(Lipoprotein_2) 		4 VAL A  70
PHE A  74
THR A  76
LYS A 134
 None
 1.23A 2kotA-1l8wA:
undetectable		 2kotA-1l8wA:
12.86
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.
1luf MUSCLE-SPECIFIC
TYROSINE KINASE
RECEPTOR MUSK

(Rattus
norvegicus) 		PF07714
(Pkinase_Tyr) 		4 MET A 604
VAL A 607
PHE A 589
ARG A 578
 None
 1.21A 2kotA-1lufA:
0.0		 2kotA-1lufA:
15.97
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.
1olp ALPHA-TOXIN

(Clostridium
sardiniense) 		PF00882
(Zn_dep_PLPC)
PF01477
(PLAT) 		4 THR A 272
PHE A 299
THR A 300
LYS A 263
 None
 1.27A 2kotA-1olpA:
0.9		 2kotA-1olpA:
13.51
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.
1p15 PROTEIN-TYROSINE
PHOSPHATASE ALPHA

(Mus musculus) 		PF00102
(Y_phosphatase) 		4 VAL A 722
THR A 731
PHE A 734
THR A 733
 None
 1.26A 2kotA-1p15A:
0.0		 2kotA-1p15A:
15.81
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.
1pio BETA-LACTAMASE

(Staphylococcus
aureus) 		PF13354
(Beta-lactamase2) 		4 VAL A 159
THR A 160
THR A 180
LYS A  64
 None
 1.25A 2kotA-1pioA:
0.0		 2kotA-1pioA:
15.98
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.
1wl4 ACETYL-COENZYME A
ACETYLTRANSFERASE 2

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 VAL A 364
THR A 365
THR A 369
ARG A 372
 None
 0.99A 2kotA-1wl4A:
undetectable		 2kotA-1wl4A:
12.90
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.
2aqx PREDICTED: INOSITOL
1,4,5-TRISPHOSPHATE
3-KINASE B

(Mus musculus) 		PF03770
(IPK) 		4 THR A 798
THR A 802
ARG A 808
LYS A 824
 None
 1.21A 2kotA-2aqxA:
0.0		 2kotA-2aqxA:
15.55
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.
2bzu FIBER PROTEIN 2

(Human
mastadenovirus
F) 		PF00541
(Adeno_knob) 		4 MET A 322
VAL A 327
THR A 326
ARG A 330
 None
 1.01A 2kotA-2bzuA:
undetectable		 2kotA-2bzuA:
16.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2cxj S100 CALCIUM-BINDING
PROTEIN A13

(Mus musculus) 		PF01023
(S_100) 		4 VAL A  16
THR A  19
PHE A  21
THR A  22
 None
 1.27A 2kotA-2cxjA:
3.7		 2kotA-2cxjA:
82.65
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.
2d3t 3-KETOACYL-COA
THIOLASE

(Pseudomonas
fragi) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 VAL C 387
THR C 386
ARG C 298
LYS C 297
 None
 0.98A 2kotA-2d3tC:
0.0		 2kotA-2d3tC:
15.61
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.
2dno TRINUCLEOTIDE REPEAT
CONTAINING 4 VARIANT

(Homo sapiens) 		PF00076
(RRM_1) 		4 THR A  96
PHE A 118
THR A 120
ARG A  71
 None
 0.97A 2kotA-2dnoA:
undetectable		 2kotA-2dnoA:
14.56
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.
2g04 PROBABLE
FATTY-ACID-COA
RACEMASE FAR

(Mycobacterium
tuberculosis) 		PF02515
(CoA_transf_3) 		4 VAL A 300
THR A 301
PHE A 293
THR A 290
 None
 1.12A 2kotA-2g04A:
undetectable		 2kotA-2g04A:
13.75
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.
2i0k OXIDOREDUCTASE

(Brevibacterium
sterolicum) 		PF01565
(FAD_binding_4)
PF09129
(Chol_subst-bind) 		4 MET A 608
VAL A 569
THR A 570
ARG A 591
 None
 1.06A 2kotA-2i0kA:
0.0		 2kotA-2i0kA:
11.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2le9 PROTEIN S100-A13

(Homo sapiens) 		PF01023
(S_100) 		5 VAL B  17
THR B  18
THR B  22
ARG B  25
LYS B  30
 None
 1.32A 2kotA-2le9B:
11.5		 2kotA-2le9B:
100.00
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.
2lu2 MICRONEME TGMIC5
PROTEIN

(Toxoplasma
gondii) 		no annotation 4 VAL A  64
THR A  65
PHE A  73
LYS A  75
 None
 1.16A 2kotA-2lu2A:
undetectable		 2kotA-2lu2A:
18.71
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.
2mgv BIFUNCTIONAL
MEMBRANE-ASSOCIATED
PENICILLIN-BINDING
PROTEIN 1A/1B PONA2

(Mycobacterium
tuberculosis) 		PF03793
(PASTA) 		4 VAL A  57
THR A  58
ARG A  16
LYS A  20
 None
 1.26A 2kotA-2mgvA:
undetectable		 2kotA-2mgvA:
17.35
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.
2mhl OUTER MEMBRANE
PROTEIN W

(Escherichia
coli) 		PF03922
(OmpW) 		4 MET A  47
PHE A  44
THR A  43
ARG A  10
 None
 1.08A 2kotA-2mhlA:
undetectable		 2kotA-2mhlA:
15.98
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.
2n8n TRANSLATION
INITIATION FACTOR
IF-1

(Staphylococcus
aureus) 		PF01176
(eIF-1a) 		4 VAL A  53
THR A  54
THR A  68
ARG A  66
 None
 1.17A 2kotA-2n8nA:
undetectable		 2kotA-2n8nA:
22.33
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.
2omv INTERNALIN-A

(Listeria
monocytogenes) 		PF08191
(LRR_adjacent)
PF12354
(Internalin_N)
PF12799
(LRR_4) 		4 VAL A  70
THR A  69
THR A  67
LYS A  58
 None
 1.24A 2kotA-2omvA:
undetectable		 2kotA-2omvA:
11.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2poa 14 KDA FATTY
ACID-BINDING PROTEIN

(Schistosoma
mansoni) 		PF00061
(Lipocalin) 		4 MET A  20
VAL A 123
THR A 119
ARG A 127
 None
 1.20A 2kotA-2poaA:
undetectable		 2kotA-2poaA:
24.29
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.
2pqv MUTT/NUDIX FAMILY
PROTEIN

(Streptococcus
pneumoniae) 		PF00293
(NUDIX) 		4 VAL A  75
PHE A  92
THR A  20
ARG A  18
 None
 1.21A 2kotA-2pqvA:
undetectable		 2kotA-2pqvA:
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.
2r19 PROTEIN YHBN

(Escherichia
coli) 		PF03968
(OstA) 		4 VAL A  52
THR A  53
PHE A  54
THR A  55
 None
 1.26A 2kotA-2r19A:
undetectable		 2kotA-2r19A:
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.
2rif CONSERVED PROTEIN
WITH 2 CBS DOMAINS

(Pyrobaculum
aerophilum) 		PF00571
(CBS) 		4 VAL A 103
THR A  83
ARG A   3
LYS A   2
 None
 1.03A 2kotA-2rifA:
undetectable		 2kotA-2rifA:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vxo GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Homo sapiens) 		PF00117
(GATase)
PF00958
(GMP_synt_C)
PF02540
(NAD_synthase) 		4 VAL A 133
PHE A 140
THR A 136
ARG A 141
 None
 0.94A 2kotA-2vxoA:
undetectable		 2kotA-2vxoA:
9.33
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.
2yhe SEC-ALKYL SULFATASE

(Pseudomonas sp.
DSM 6611) 		PF00753
(Lactamase_B)
PF14863
(Alkyl_sulf_dimr)
PF14864
(Alkyl_sulf_C) 		4 MET A  86
VAL A  83
THR A 255
THR A 253
 None
 1.26A 2kotA-2yheA:
undetectable		 2kotA-2yheA:
9.81
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.
2z5l TYLACTONE SYNTHASE
STARTER MODULE AND
MODULES 1 & 2

(Streptomyces
fradiae) 		PF08659
(KR) 		4 VAL A 318
PHE A 365
THR A 405
ARG A 398
 None
 1.11A 2kotA-2z5lA:
undetectable		 2kotA-2z5lA:
10.37
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.
3al8 SEMAPHORIN-6A

(Mus musculus) 		PF01403
(Sema)
PF01437
(PSI) 		4 THR A 505
PHE A 503
ARG A 486
LYS A 444
 None
 1.22A 2kotA-3al8A:
undetectable		 2kotA-3al8A:
9.63
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.
3c6a TERMINASE LARGE
SUBUNIT

(Escherichia
virus RB49) 		PF17289
(Terminase_6C) 		4 VAL A 541
PHE A 523
THR A 522
LYS A 359
 None
 1.14A 2kotA-3c6aA:
undetectable		 2kotA-3c6aA:
19.40
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.
3dbk ELASTASE

(Pseudomonas
aeruginosa) 		PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C) 		4 VAL A 286
THR A 287
PHE A 290
THR A 296
 None
 1.25A 2kotA-3dbkA:
undetectable		 2kotA-3dbkA:
14.95
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.
3ef8 PUTATIVE SCYALONE
DEHYDRATASE

(Novosphingobium
aromaticivorans) 		PF13577
(SnoaL_4) 		4 THR A  64
PHE A  66
THR A  99
ARG A  67
 None
 1.17A 2kotA-3ef8A:
undetectable		 2kotA-3ef8A:
17.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g6e 50S RIBOSOMAL
PROTEIN L23P

(Haloarcula
marismortui) 		PF00276
(Ribosomal_L23) 		4 VAL S  47
THR S  48
ARG S  67
LYS S  23
 None
None
C  01508 ( 4.3A)
C  01507 ( 2.6A)
 1.16A 2kotA-3g6eS:
undetectable		 2kotA-3g6eS:
24.00
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.
3hbu SECRETED PROTEASE C

(Dickeya
chrysanthemi) 		PF00353
(HemolysinCabind)
PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		4 THR P 119
PHE P 120
THR P 121
LYS P 106
 None
 0.99A 2kotA-3hbuP:
undetectable		 2kotA-3hbuP:
11.73
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.
3hea ARYLESTERASE

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		4 VAL A 195
THR A 196
PHE A 198
THR A 201
 None
GOL  A 273 (-3.6A)
EEE  A 300 ( 4.3A)
None
 1.14A 2kotA-3heaA:
undetectable		 2kotA-3heaA:
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.
3hui FERREDOXIN

(Rhodopseudomonas
palustris) 		PF00111
(Fer2) 		4 VAL A  98
THR A  99
PHE A   5
ARG A  13
 None
 1.26A 2kotA-3huiA:
undetectable		 2kotA-3huiA:
18.11
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.
3k4i UNCHARACTERIZED
PROTEIN

(Pseudomonas
syringae group
genomosp. 3) 		PF03737
(RraA-like) 		4 MET A 104
VAL A 128
THR A 127
ARG A 123
 CL  A 502 (-3.7A)
None
None
None
 1.24A 2kotA-3k4iA:
undetectable		 2kotA-3k4iA:
15.92
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.
3lcv SISOMICIN-GENTAMICIN
RESISTANCE METHYLASE
SGM

(Micromonospora
zionensis) 		PF07091
(FmrO) 		4 VAL B  26
THR B  25
THR B  18
LYS B  54
 None
 1.26A 2kotA-3lcvB:
undetectable		 2kotA-3lcvB:
13.77
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.
3m92 PROTEIN YCIN

(Shigella
flexneri) 		PF10692
(DUF2498) 		4 MET A  67
THR A  46
PHE A  45
THR A  34
 None
 1.23A 2kotA-3m92A:
undetectable		 2kotA-3m92A:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mj9 JUNCTIONAL ADHESION
MOLECULE-LIKE

(Mus musculus) 		PF07686
(V-set) 		4 VAL A 166
THR A 165
PHE A 184
ARG A 185
 None
 1.27A 2kotA-3mj9A:
undetectable		 2kotA-3mj9A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mmn HISTIDINE KINASE
HOMOLOG

(Arabidopsis
thaliana) 		PF00072
(Response_reg) 		4 VAL A1026
THR A1027
THR A1031
LYS A1041
 None
 0.79A 2kotA-3mmnA:
undetectable		 2kotA-3mmnA:
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.
3oth CALG1

(Micromonospora
echinospora) 		PF00201
(UDPGT)
PF03033
(Glyco_transf_28) 		4 VAL A  31
THR A  32
PHE A  48
ARG A  44
 None
 1.19A 2kotA-3othA:
undetectable		 2kotA-3othA:
12.53
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.
3pnz PHOSPHOTRIESTERASE
FAMILY PROTEIN

(Listeria
monocytogenes) 		PF02126
(PTE) 		4 VAL A 269
PHE A 318
THR A  19
LYS A 315
 None
 0.98A 2kotA-3pnzA:
undetectable		 2kotA-3pnzA:
16.06
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.
3rj9 ALCOHOL
DEHYDROGENASE

(Scaptodrosophila
lebanonensis) 		PF00106
(adh_short) 		4 VAL A  85
THR A  84
PHE A  79
LYS A  76
 None
 1.11A 2kotA-3rj9A:
undetectable		 2kotA-3rj9A:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3w2w CRISPR SYSTEM CMR
SUBUNIT CMR3

(Pyrococcus
furiosus) 		PF09700
(Cas_Cmr3) 		4 VAL B   4
THR B   5
PHE B   6
THR B   7
 None
 1.24A 2kotA-3w2wB:
undetectable		 2kotA-3w2wB:
13.35
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.
3x43 O-UREIDO-L-SERINE
SYNTHASE

(Streptomyces
lavendulae) 		PF00291
(PALP) 		4 VAL A 245
THR A 246
THR A 250
ARG A 253
 None
 0.91A 2kotA-3x43A:
undetectable		 2kotA-3x43A:
13.42
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.
4b29 DIMETHYLSULFONIOPROP
IONATE LYASE

(Roseovarius
nubinhibens) 		PF16867
(DMSP_lyase) 		4 VAL A 115
THR A 114
PHE A  97
ARG A  39
 None
EDO  A1201 (-3.3A)
None
None
 1.13A 2kotA-4b29A:
undetectable		 2kotA-4b29A:
17.14
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.
4b5q GLYCOSIDE HYDROLASE
FAMILY 61 PROTEIN D

(Phanerochaete
chrysosporium) 		PF03443
(Glyco_hydro_61) 		4 VAL A  36
THR A  37
PHE A  41
ARG A  42
 None
 0.84A 2kotA-4b5qA:
undetectable		 2kotA-4b5qA:
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.
4bf5 ALANINE RACEMASE

(Aeromonas
hydrophila) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 MET A 352
THR A 303
PHE A 304
THR A 297
 None
 1.08A 2kotA-4bf5A:
undetectable		 2kotA-4bf5A:
12.84
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.
4dgw PRE-MRNA-SPLICING
FACTOR PRP21

(Saccharomyces
cerevisiae) 		PF01805
(Surp) 		4 THR B 136
PHE B 135
THR B 134
LYS B  97
 None
 1.23A 2kotA-4dgwB:
undetectable		 2kotA-4dgwB:
19.08
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.
4dqk BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE

(Bacillus
megaterium) 		PF00175
(NAD_binding_1)
PF00667
(FAD_binding_1) 		4 VAL A 715
THR A 716
PHE A 719
LYS A 814
 None
 1.26A 2kotA-4dqkA:
undetectable		 2kotA-4dqkA:
15.96
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.
4dyj BROAD SPECIFICITY
AMINO ACID RACEMASE

(Pseudomonas
putida) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 MET A 353
THR A 304
PHE A 305
THR A 298
 None
 1.04A 2kotA-4dyjA:
undetectable		 2kotA-4dyjA:
12.96
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.
4fwt ELONGATION FACTOR
TS, ELONGATION
FACTOR TU, LINKER, Q
BETA REPLICASE

(Escherichia
coli;
Escherichia
virus Qbeta) 		PF00009
(GTP_EFTU)
PF00889
(EF_TS)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
PF03431
(RNA_replicase_B) 		4 VAL A 645
THR A 646
PHE A 589
LYS A 675
 None
 1.24A 2kotA-4fwtA:
undetectable		 2kotA-4fwtA:
5.72
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.
4ipe TNF
RECEPTOR-ASSOCIATED
PROTEIN 1

(Danio rerio) 		PF00183
(HSP90)
PF13589
(HATPase_c_3) 		4 VAL A 614
THR A 615
ARG A 588
LYS A 588
 None
 1.11A 2kotA-4ipeA:
undetectable		 2kotA-4ipeA:
9.60
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.
4jnj STREPTAVIDIN/RHIZAVI
DIN HYBRID

(Streptomyces
avidinii) 		PF01382
(Avidin) 		4 VAL A  31
THR A  30
PHE A  29
THR A  28
 None
 1.27A 2kotA-4jnjA:
undetectable		 2kotA-4jnjA:
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.
4lis UDP-GLUCOSE
4-EPIMERASE

(Aspergillus
nidulans) 		PF16363
(GDP_Man_Dehyd) 		4 VAL A  62
THR A  63
PHE A  68
ARG A 113
 NAD  A 402 (-3.8A)
NAD  A 402 ( 4.7A)
None
None
 1.26A 2kotA-4lisA:
undetectable		 2kotA-4lisA:
13.48
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.
4mb5 CHITINASE 60

(Moritella
marina) 		PF00704
(Glyco_hydro_18)
PF16403
(DUF5011) 		4 MET A 445
VAL A 498
THR A 434
THR A 432
 None
 1.22A 2kotA-4mb5A:
undetectable		 2kotA-4mb5A:
11.59
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.
4mdk UBIQUITIN-CONJUGATIN
G ENZYME E2 R1

(Homo sapiens) 		PF00179
(UQ_con) 		4 VAL A  30
THR A  31
ARG A  61
LYS A  63
 None
 1.24A 2kotA-4mdkA:
undetectable		 2kotA-4mdkA:
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.
4mfi SN-GLYCEROL-3-PHOSPH
ATE ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN USPB

(Mycobacterium
tuberculosis) 		PF13416
(SBP_bac_8) 		4 VAL A 409
THR A 410
PHE A 413
THR A 230
 None
 1.11A 2kotA-4mfiA:
undetectable		 2kotA-4mfiA:
13.43
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.
4mkv RIBULOSE
BISPHOSPHATE
CARBOXYLASE LARGE
CHAIN

(Pisum sativum) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 VAL A 113
THR A 114
PHE A 117
THR A 118
 None
 1.11A 2kotA-4mkvA:
undetectable		 2kotA-4mkvA:
12.72
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.
4nez ENGINEERED PROTEIN
OR276

(synthetic
construct) 		no annotation 4 MET A  88
VAL A 156
PHE A  91
ARG A 125
 4NE  A 202 ( 4.8A)
None
None
None
 1.27A 2kotA-4nezA:
undetectable		 2kotA-4nezA:
23.93
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.
4pdc CPXV018 PROTEIN

(Cowpox virus) 		no annotation 4 THR E  19
PHE E  32
THR E  31
ARG E  38
 None
 0.89A 2kotA-4pdcE:
undetectable		 2kotA-4pdcE:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q4j ABC TRANSPORTER

(Thermotoga
maritima) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		4 VAL A 490
THR A 520
THR A 516
LYS A 487
 None
 1.09A 2kotA-4q4jA:
undetectable		 2kotA-4q4jA:
12.47
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.
4r2g SURFACE PROTEIN
GP160

(Human
immunodeficiency
virus 1) 		no annotation 4 THR E 388
PHE E 391
THR E 362
ARG E 469
 NAG  E 515 (-3.9A)
None
None
None
 1.03A 2kotA-4r2gE:
undetectable		 2kotA-4r2gE:
13.07
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.
4rnr PGT130 LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL B  75
THR B  74
PHE B  62
ARG B  54
 None
 1.27A 2kotA-4rnrB:
undetectable		 2kotA-4rnrB:
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.
4ruh CYTOSOLIC
NON-SPECIFIC
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		4 VAL A 404
THR A 403
PHE A 405
LYS A 203
 None
 1.22A 2kotA-4ruhA:
undetectable		 2kotA-4ruhA:
12.00
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.
4s38 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE

(Thermus
thermophilus) 		PF04551
(GcpE) 		4 VAL A  59
THR A  58
PHE A  88
ARG A 110
 None
 1.15A 2kotA-4s38A:
undetectable		 2kotA-4s38A:
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.
4u90 GEPHYRIN

(Rattus
norvegicus) 		PF00994
(MoCF_biosynth)
PF03453
(MoeA_N)
PF03454
(MoeA_C) 		4 MET A 504
VAL A 501
THR A 541
ARG A 564
 None
 1.11A 2kotA-4u90A:
undetectable		 2kotA-4u90A:
12.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ued EUKARYOTIC
TRANSLATION
INITIATION FACTOR 4E

(Homo sapiens) 		PF01652
(IF4E) 		4 THR A  68
PHE A  66
ARG A  42
LYS A  65
 None
 1.24A 2kotA-4uedA:
undetectable		 2kotA-4uedA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xhz PROTOCADHERIN-15

(Homo sapiens) 		PF00028
(Cadherin) 		4 VAL A 891
THR A 890
PHE A 873
ARG A 836
 None
 1.27A 2kotA-4xhzA:
undetectable		 2kotA-4xhzA:
14.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4xpf ANTIBODY FRAGMENT
LIGHT CHAIN-PROTEIN,
9D5-LIGHT CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL H  64
THR H  65
PHE H  68
THR H  69
 None
 1.15A 2kotA-4xpfH:
undetectable		 2kotA-4xpfH:
14.94
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.
4xru HEN1

(Capnocytophaga
gingivalis) 		no annotation 4 VAL C 173
THR C 174
THR C 178
ARG C 216
 None
 0.62A 2kotA-4xruC:
undetectable		 2kotA-4xruC:
11.47
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.
4yn1 FUSOLIN

(Anomala cuprea
entomopoxvirus) 		PF03067
(LPMO_10) 		4 VAL A 165
PHE A 158
THR A 155
ARG A 205
 None
 1.19A 2kotA-4yn1A:
undetectable		 2kotA-4yn1A:
14.46
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.
4zon VERRUCULOGEN
SYNTHASE

(Aspergillus
fumigatus) 		PF05721
(PhyH) 		4 VAL A  89
THR A  88
PHE A  85
ARG A  86
 None
 1.27A 2kotA-4zonA:
undetectable		 2kotA-4zonA:
16.99
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.
5aoh CARF

(Serratia sp.
ATCC 39006) 		PF03781
(FGE-sulfatase) 		4 MET A  40
VAL A  10
PHE A  37
ARG A 263
 None
 1.12A 2kotA-5aohA:
undetectable		 2kotA-5aohA:
16.85
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.
5bnn CAPSID PROTEIN VP1

(Enterovirus D) 		PF00073
(Rhv) 		4 VAL A 235
THR A 234
PHE A  74
LYS A  86
 None
 1.25A 2kotA-5bnnA:
undetectable		 2kotA-5bnnA:
16.11
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.
5bnn CAPSID PROTEIN VP1

(Enterovirus D) 		PF00073
(Rhv) 		4 VAL A 235
THR A 234
PHE A  74
LYS A  88
 None
 1.04A 2kotA-5bnnA:
undetectable		 2kotA-5bnnA:
16.11
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.
5d7w SERRALYSIN

(Serratia
marcescens) 		PF00353
(HemolysinCabind)
PF00413
(Peptidase_M10)
PF08548
(Peptidase_M10_C) 		4 THR A 103
PHE A 104
THR A 105
LYS A  90
 THR  A 103 ( 0.8A)
PHE  A 104 ( 1.3A)
THR  A 105 ( 0.8A)
LYS  A  90 ( 0.0A)
 1.02A 2kotA-5d7wA:
undetectable		 2kotA-5d7wA:
11.85
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.
5dk3 HEAVY CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL B  11
THR B 117
THR B 115
LYS B 208
 None
 1.18A 2kotA-5dk3B:
undetectable		 2kotA-5dk3B:
12.53
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.
5f7v LMO0181 PROTEIN

(Listeria
monocytogenes) 		PF01547
(SBP_bac_1) 		4 VAL A 195
THR A 196
THR A 386
LYS A 392
 None
GLC  A 501 ( 4.9A)
None
None
 1.16A 2kotA-5f7vA:
undetectable		 2kotA-5f7vA:
15.54
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.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT ZETA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		4 VAL z 331
THR z 332
THR z 371
LYS z 211
 None
 1.15A 2kotA-5gw5z:
undetectable		 2kotA-5gw5z:
12.73
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.
5hm5 TOPOISOMERASE V

(Methanopyrus
kandleri) 		PF13412
(HTH_24)
PF14520
(HHH_5) 		4 VAL A 152
THR A 242
ARG A 245
LYS A 248
 None
 1.15A 2kotA-5hm5A:
undetectable		 2kotA-5hm5A:
8.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jw6 ASPARTATE-SEMIALDEHY
DE DEHYDROGENASE

(Aspergillus
fumigatus) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		4 MET A 252
VAL A 255
PHE A 335
ARG A 321
 None
 1.10A 2kotA-5jw6A:
undetectable		 2kotA-5jw6A:
13.89
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.
5l44 K-26 DIPEPTIDYL
CARBOXYPEPTIDASE

(Astrosporangium
hypotensionis) 		PF01432
(Peptidase_M3) 		4 VAL A  65
THR A  64
PHE A  61
THR A  60
 None
 1.13A 2kotA-5l44A:
undetectable		 2kotA-5l44A:
10.17
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.
5m99 ALPHA-AMYLASE

(Thermotoga
petrophila) 		PF00128
(Alpha-amylase) 		4 VAL B 474
PHE B 463
THR B 452
LYS B 343
 None
 0.98A 2kotA-5m99B:
undetectable		 2kotA-5m99B:
11.11
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.
5myk FAB C#17 HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 VAL B  64
THR B  65
PHE B  68
THR B  69
 None
 1.11A 2kotA-5mykB:
undetectable		 2kotA-5mykB:
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.
5n8n EVPB FAMILY TYPE VI
SECRETION PROTEIN

(Pseudomonas
aeruginosa) 		no annotation 4 THR B 217
PHE B 220
THR B 221
ARG B 229
 None
 1.00A 2kotA-5n8nB:
undetectable		 2kotA-5n8nB:
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.
5oqj RNA POLYMERASE II
TRANSCRIPTION FACTOR
B SUBUNIT 1

(Saccharomyces
cerevisiae) 		no annotation 4 VAL 1 199
THR 1 198
PHE 1 195
ARG 1 213
 None
 1.27A 2kotA-5oqj1:
undetectable		 2kotA-5oqj1:
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.
5oqm GENERAL
TRANSCRIPTION AND
DNA REPAIR FACTOR
IIH SUBUNIT TFB1

(Saccharomyces
cerevisiae) 		no annotation 4 VAL 1 199
THR 1 198
PHE 1 195
ARG 1 213
 None
 1.27A 2kotA-5oqm1:
undetectable		 2kotA-5oqm1:
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.
5tg8 HEMAGGLUTININ HA1
CHAIN

(Influenza A
virus) 		PF00509
(Hemagglutinin) 		4 VAL A 243
THR A 244
PHE A 245
THR A 246
 None
 1.10A 2kotA-5tg8A:
undetectable		 2kotA-5tg8A:
16.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tpk PROTOCADHERIN-15

(Mus musculus) 		no annotation 4 VAL A 891
THR A 890
PHE A 873
ARG A 836
 None
 1.02A 2kotA-5tpkA:
undetectable		 2kotA-5tpkA:
17.13
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.
5ue8 PROTEIN UNC-13
HOMOLOG A

(Rattus
norvegicus) 		PF00130
(C1_1)
PF00168
(C2)
PF06292
(DUF1041)
PF10540
(Membr_traf_MHD) 		4 PHE A 569
THR A 598
ARG A 596
LYS A 603
 None
 1.14A 2kotA-5ue8A:
undetectable		 2kotA-5ue8A:
8.21
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.
5vae ACCESSORY SEC SYSTEM
PROTEIN ASP1

(Streptococcus
gordonii) 		no annotation 4 MET A   1
VAL A 232
PHE A   4
LYS A  50
 None
 1.21A 2kotA-5vaeA:
undetectable		 2kotA-5vaeA:
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.
5yua ION TRANSPORT
PROTEIN

(Arcobacter
butzleri) 		no annotation 4 VAL A1052
THR A1054
PHE A1056
THR A1057
 None
 1.24A 2kotA-5yuaA:
undetectable		 2kotA-5yuaA:
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.
6fay ODZ3 PROTEIN

(Mus musculus) 		no annotation 4 VAL A1996
PHE A1984
THR A1985
ARG A1967
 None
 1.02A 2kotA-6fayA:
undetectable		 2kotA-6fayA:
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.
6fay ODZ3 PROTEIN

(Mus musculus) 		no annotation 4 VAL A1996
THR A1995
PHE A1984
ARG A1967
 None
 1.09A 2kotA-6fayA:
undetectable		 2kotA-6fayA:
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.
6fwy -

(-) 		no annotation 4 MET A 199
THR A 174
PHE A 175
THR A 176
 None
 1.20A 2kotA-6fwyA:
undetectable		 2kotA-6fwyA:
undetectable