SIMILAR PATTERNS OF AMINO ACIDS FOR 4MK4_A_CHDA504

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.
1czf POLYGALACTURONASE II

(Aspergillus
niger) 		PF00295
(Glyco_hydro_28) 		4 PRO A 357
SER A 358
VAL A 359
GLY A 332
 None
 0.89A 4mk4A-1czfA:
undetectable		 4mk4A-1czfA:
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.
1ep2 DIHYDROOROTATE
DEHYDROGENASE B
(PYRK SUBUNIT)

(Lactococcus
lactis) 		PF00175
(NAD_binding_1)
PF10418
(DHODB_Fe-S_bind) 		4 MET B 220
PRO B 124
SER B  56
GLY B 119
 None
None
FAD  B 503 (-3.2A)
None
 1.03A 4mk4A-1ep2B:
3.0		 4mk4A-1ep2B:
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.
1f9a HYPOTHETICAL PROTEIN
MJ0541

(Methanocaldococcus
jannaschii) 		PF01467
(CTP_transf_like) 		4 PRO A  46
ARG A   8
VAL A 157
GLY A 156
 None
ATP  A 700 (-3.0A)
None
None
 0.98A 4mk4A-1f9aA:
undetectable		 4mk4A-1f9aA:
21.53
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.
1h81 POLYAMINE OXIDASE

(Zea mays) 		PF01593
(Amino_oxidase) 		4 ARG A 356
PRO A 174
VAL A 177
GLY A 327
 None
 0.93A 4mk4A-1h81A:
undetectable		 4mk4A-1h81A:
21.34
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.
1hyb NICOTINAMIDE
MONONUCLEOTIDE
ADENYLYLTRANSFERASE

(Methanothermobacter
thermautotrophicus) 		PF01467
(CTP_transf_like) 		5 ARG A 146
PRO A  49
ARG A  11
VAL A 163
GLY A 162
 None
None
SO4  A1759 ( 3.2A)
None
None
 1.09A 4mk4A-1hybA:
3.3		 4mk4A-1hybA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ijx SECRETED
FRIZZLED-RELATED
SEQUENCE PROTEIN 3

(Mus musculus) 		PF01392
(Fz) 		4 SER A  78
VAL A  79
VAL A 114
GLY A 113
 None
 0.99A 4mk4A-1ijxA:
undetectable		 4mk4A-1ijxA:
14.83
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.
1ijx SECRETED
FRIZZLED-RELATED
SEQUENCE PROTEIN 3

(Mus musculus) 		PF01392
(Fz) 		4 VAL A  79
ARG A  82
VAL A 114
GLY A 113
 None
 0.94A 4mk4A-1ijxA:
undetectable		 4mk4A-1ijxA:
14.83
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.
1kcm PHOSPHATIDYLINOSITOL
TRANSFER PROTEIN
ALPHA

(Mus musculus) 		PF02121
(IP_trans) 		4 ARG A 147
PRO A  12
VAL A  13
GLY A 175
 None
 0.98A 4mk4A-1kcmA:
undetectable		 4mk4A-1kcmA:
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.
1kkr 3-METHYLASPARTATE
AMMONIA-LYASE

(Citrobacter
amalonaticus) 		PF05034
(MAAL_N)
PF07476
(MAAL_C) 		4 ARG A 369
VAL A 106
VAL A  66
GLY A  67
 None
 1.01A 4mk4A-1kkrA:
undetectable		 4mk4A-1kkrA:
19.48
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		4 ARG A 467
PRO A  55
VAL A 264
VAL A  57
 None
 0.88A 4mk4A-1l5jA:
2.5		 4mk4A-1l5jA:
19.25
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1lbq FERROCHELATASE

(Saccharomyces
cerevisiae) 		PF00762
(Ferrochelatase) 		5 ARG A  87
PRO A 238
VAL A 241
VAL A 277
GLY A 278
 None
 0.73A 4mk4A-1lbqA:
48.3		 4mk4A-1lbqA:
49.33
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.
1ldm M4 LACTATE
DEHYDROGENASE

(Squalus
acanthias) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 PRO A 269
SER A 287
VAL A 270
GLY A 187
 None
 1.01A 4mk4A-1ldmA:
3.1		 4mk4A-1ldmA:
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.
1mb9 BETA-LACTAM
SYNTHETASE

(Streptomyces
clavuligerus) 		PF00733
(Asn_synthase)
PF13537
(GATase_7) 		4 SER A 503
VAL A 504
ARG A 507
VAL A 495
 None
 1.01A 4mk4A-1mb9A:
undetectable		 4mk4A-1mb9A:
21.54
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.
1o94 TRIMETHYLAMINE
DEHYDROGENASE

(Methylophilus
methylotrophus) 		PF00724
(Oxidored_FMN)
PF07992
(Pyr_redox_2) 		4 VAL A 691
ARG A 690
VAL A 395
GLY A 396
 None
None
ADP  A1731 (-4.7A)
ADP  A1731 (-3.4A)
 0.89A 4mk4A-1o94A:
3.0		 4mk4A-1o94A:
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.
1oh2 SUCROSE SPECIFIC
PORIN

(Salmonella
enterica) 		PF02264
(LamB) 		4 MET Q 258
VAL Q 203
VAL Q 288
GLY Q 262
 None
 0.99A 4mk4A-1oh2Q:
undetectable		 4mk4A-1oh2Q:
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.
1qdb CYTOCHROME C NITRITE
REDUCTASE

(Sulfurospirillum
deleyianum) 		PF02335
(Cytochrom_C552) 		4 ARG A 418
PRO A 283
VAL A 253
GLY A 252
 SO4  A1506 (-3.5A)
None
None
None
 0.89A 4mk4A-1qdbA:
undetectable		 4mk4A-1qdbA:
20.90
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.
1rdk MANNOSE-BINDING
PROTEIN-C

(Rattus rattus) 		PF00059
(Lectin_C) 		4 PRO 1 213
SER 1 215
VAL 1 194
GLY 1 195
 CL  1   3 (-4.6A)
None
None
None
 0.81A 4mk4A-1rdk1:
undetectable		 4mk4A-1rdk1:
15.69
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.
1t2f L-LACTATE
DEHYDROGENASE B
CHAIN

(Homo sapiens) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 PRO A 272
SER A 290
VAL A 273
GLY A 187
 None
 1.01A 4mk4A-1t2fA:
3.4		 4mk4A-1t2fA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u8x MALTOSE-6'-PHOSPHATE
GLUCOSIDASE

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 PRO X 174
VAL X 175
ARG X 190
GLY X 199
 None
 1.02A 4mk4A-1u8xX:
1.8		 4mk4A-1u8xX:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1u8x MALTOSE-6'-PHOSPHATE
GLUCOSIDASE

(Bacillus
subtilis) 		PF02056
(Glyco_hydro_4)
PF11975
(Glyco_hydro_4C) 		4 PRO X 174
VAL X 175
ARG X 190
GLY X 204
 None
 0.88A 4mk4A-1u8xX:
1.8		 4mk4A-1u8xX:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xru 4-DEOXY-L-THREO-5-HE
XOSULOSE-URONATE
KETOL-ISOMERASE

(Escherichia
coli) 		PF04962
(KduI) 		4 MET A 179
VAL A 171
VAL A 106
GLY A 107
 None
 0.98A 4mk4A-1xruA:
undetectable		 4mk4A-1xruA:
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.
1y7p HYPOTHETICAL PROTEIN
AF1403

(Archaeoglobus
fulgidus) 		PF01842
(ACT) 		4 PRO A 182
SER A 174
VAL A 188
GLY A 155
 None
 0.99A 4mk4A-1y7pA:
3.7		 4mk4A-1y7pA:
22.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yve ACETOHYDROXY ACID
ISOMEROREDUCTASE

(Spinacia
oleracea) 		PF01450
(IlvC)
PF07991
(IlvN) 		4 PRO I 251
SER I 225
VAL I 249
GLY I 255
 NDP  I 600 (-4.7A)
NDP  I 600 (-4.9A)
None
NDP  I 600 (-3.9A)
 0.90A 4mk4A-1yveI:
2.8		 4mk4A-1yveI:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a2l UNKNOWN

(Klebsiella
pneumoniae) 		PF03928
(Haem_degrading) 		4 SER A  64
VAL A 123
VAL A 111
GLY A 119
 None
 0.98A 4mk4A-2a2lA:
undetectable		 4mk4A-2a2lA:
16.21
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.
2akj FERREDOXIN--NITRITE
REDUCTASE,
CHLOROPLAST

(Spinacia
oleracea) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 PRO A 227
VAL A 178
VAL A 229
GLY A 183
 None
 0.93A 4mk4A-2akjA:
undetectable		 4mk4A-2akjA:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bht CYSTEINE SYNTHASE B

(Escherichia
coli) 		PF00291
(PALP) 		4 MET A  95
SER A 288
VAL A 254
GLY A 253
 None
 0.90A 4mk4A-2bhtA:
undetectable		 4mk4A-2bhtA:
22.45
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.
2bol SMALL HEAT SHOCK
PROTEIN

(Taenia saginata) 		PF00011
(HSP20) 		4 PRO A 163
SER A 165
VAL A 166
GLY A 256
 None
 0.86A 4mk4A-2bolA:
undetectable		 4mk4A-2bolA:
23.38
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.
2d1c ISOCITRATE
DEHYDROGENASE

(Thermus
thermophilus) 		PF00180
(Iso_dh) 		4 SER A  59
VAL A  60
ARG A  63
GLY A  86
 None
 0.69A 4mk4A-2d1cA:
4.0		 4mk4A-2d1cA:
22.38
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.
2f1s VIRAL CASP8 AND
FADD-LIKE APOPTOSIS
REGULATOR

(Molluscum
contagiosum
virus) 		PF01335
(DED) 		4 ARG A 166
VAL A 149
VAL A 103
GLY A 104
 None
 1.01A 4mk4A-2f1sA:
undetectable		 4mk4A-2f1sA:
20.21
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.
2f6r BIFUNCTIONAL
COENZYME A SYNTHASE

(Mus musculus) 		PF01121
(CoaE) 		4 MET A 224
SER A  74
VAL A 191
GLY A  67
 None
 1.03A 4mk4A-2f6rA:
undetectable		 4mk4A-2f6rA:
20.87
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.
2f6r BIFUNCTIONAL
COENZYME A SYNTHASE

(Mus musculus) 		PF01121
(CoaE) 		4 MET A 224
VAL A 195
VAL A 191
GLY A  67
 None
 0.96A 4mk4A-2f6rA:
undetectable		 4mk4A-2f6rA:
20.87
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.
2ftw DIHYDROPYRIMIDINE
AMIDOHYDROLASE

(Dictyostelium
discoideum) 		PF01979
(Amidohydro_1) 		4 PRO A  60
SER A 378
VAL A 374
GLY A 400
 None
 1.01A 4mk4A-2ftwA:
undetectable		 4mk4A-2ftwA:
20.79
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.
2i6d RNA
METHYLTRANSFERASE,
TRMH FAMILY

(Porphyromonas
gingivalis) 		PF00588
(SpoU_methylase) 		4 ARG A 207
SER A 140
VAL A 143
GLY A 134
 None
 0.96A 4mk4A-2i6dA:
3.1		 4mk4A-2i6dA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i99 MU-CRYSTALLIN
HOMOLOG

(Homo sapiens) 		PF02423
(OCD_Mu_crystall) 		4 SER A  87
VAL A  88
VAL A 146
GLY A 145
 None
None
NDP  A 502 (-3.9A)
NDP  A 502 (-3.0A)
 1.02A 4mk4A-2i99A:
2.5		 4mk4A-2i99A:
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.
2kfg EH DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF12763
(EF-hand_4) 		4 PRO A 132
SER A 134
VAL A  46
GLY A  47
 None
 0.61A 4mk4A-2kfgA:
undetectable		 4mk4A-2kfgA:
13.91
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.
2kfu RV1827 PTHR 22

(Mycobacterium
tuberculosis) 		PF00498
(FHA) 		4 ARG A  96
VAL A 121
VAL A 113
GLY A 114
 None
 0.94A 4mk4A-2kfuA:
undetectable		 4mk4A-2kfuA:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2kxh POLY(U)-BINDING-SPLI
CING FACTOR PUF60

(Homo sapiens) 		PF00076
(RRM_1) 		4 SER A 175
VAL A 176
VAL A 282
GLY A 283
 None
 1.03A 4mk4A-2kxhA:
undetectable		 4mk4A-2kxhA:
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.
2ldx APO-LACTATE
DEHYDROGENASE

(Mus musculus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		4 PRO A 271
SER A 289
VAL A 272
GLY A 186
 None
 1.01A 4mk4A-2ldxA:
3.8		 4mk4A-2ldxA:
21.99
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.
2o2q FORMYLTETRAHYDROFOLA
TE DEHYDROGENASE

(Rattus
norvegicus) 		PF00171
(Aldedh) 		4 ARG A 814
SER A 698
VAL A 699
VAL A 724
 None
 0.97A 4mk4A-2o2qA:
undetectable		 4mk4A-2o2qA:
22.79
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.
2obv S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-1

(Homo sapiens) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		4 VAL A 359
ARG A 362
VAL A 324
GLY A 323
 None
 0.86A 4mk4A-2obvA:
undetectable		 4mk4A-2obvA:
21.26
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.
2okj GLUTAMATE
DECARBOXYLASE 1

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		4 MET A 261
SER A 398
VAL A 418
GLY A 252
 None
None
None
LLP  A 405 ( 3.4A)
 0.93A 4mk4A-2okjA:
4.6		 4mk4A-2okjA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okk GLUTAMATE
DECARBOXYLASE 2

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		4 MET A 252
SER A 389
VAL A 409
GLY A 243
 None
None
None
LLP  A 396 ( 3.6A)
 1.01A 4mk4A-2okkA:
4.1		 4mk4A-2okkA:
21.57
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.
2p68 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Aquifex
aeolicus) 		PF13561
(adh_short_C2) 		4 PRO A 187
VAL A 221
VAL A 146
GLY A 147
 None
 0.87A 4mk4A-2p68A:
3.1		 4mk4A-2p68A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p68 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE

(Aquifex
aeolicus) 		PF13561
(adh_short_C2) 		4 SER A 144
VAL A 145
VAL A 152
GLY A 153
 None
 0.69A 4mk4A-2p68A:
3.1		 4mk4A-2p68A:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ph3 3-OXOACYL-[ACYL
CARRIER PROTEIN]
REDUCTASE

(Thermus
thermophilus) 		PF13561
(adh_short_C2) 		4 PRO A 182
VAL A 216
VAL A 141
GLY A 142
 None
 0.89A 4mk4A-2ph3A:
2.4		 4mk4A-2ph3A:
24.21
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.
2q2r GLUCOKINASE 1,
PUTATIVE

(Trypanosoma
cruzi) 		PF02685
(Glucokinase) 		4 PRO A  77
SER A  79
VAL A  80
ARG A  83
 None
 0.87A 4mk4A-2q2rA:
undetectable		 4mk4A-2q2rA:
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.
2q7t PROTEIN TRAI

(Escherichia
coli) 		PF08751
(TrwC) 		4 PRO A  87
SER A  89
VAL A  90
GLY A 222
 None
 0.88A 4mk4A-2q7tA:
undetectable		 4mk4A-2q7tA:
21.92
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.
2vyo POLYSACCHARIDE
DEACETYLASE
DOMAIN-CONTAINING
PROTEIN ECU11_0510

(Encephalitozoon
cuniculi) 		PF01522
(Polysacc_deac_1) 		4 VAL A  40
ARG A  43
VAL A  66
GLY A  67
 None
 1.03A 4mk4A-2vyoA:
undetectable		 4mk4A-2vyoA:
19.63
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.
2x0f WSAF

(Geobacillus
stearothermophilus) 		no annotation 4 SER A 251
VAL A 252
VAL A 282
GLY A 301
 None
GOL  A1415 (-3.8A)
TRH  A 416 ( 4.4A)
None
 0.90A 4mk4A-2x0fA:
3.7		 4mk4A-2x0fA:
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.
2xsg CCMAN5

(Cellulosimicrobium
cellulans) 		PF07971
(Glyco_hydro_92) 		4 ARG A  42
PRO A 402
SER A 350
GLY A  74
 None
 1.03A 4mk4A-2xsgA:
undetectable		 4mk4A-2xsgA:
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.
2ycb CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR

(Methanothermobacter
thermautotrophicus) 		PF07521
(RMMBL)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		4 PRO A 252
SER A 301
VAL A 298
GLY A 210
 None
 0.88A 4mk4A-2ycbA:
3.8		 4mk4A-2ycbA:
20.74
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.
2ycb CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR

(Methanothermobacter
thermautotrophicus) 		PF07521
(RMMBL)
PF10996
(Beta-Casp)
PF16661
(Lactamase_B_6)
PF17214
(KH_7) 		4 PRO A 252
VAL A 298
VAL A 211
GLY A 210
 None
 0.96A 4mk4A-2ycbA:
3.8		 4mk4A-2ycbA:
20.74
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.
2z0m 337AA LONG
HYPOTHETICAL
ATP-DEPENDENT RNA
HELICASE DEAD

(Sulfurisphaera
tokodaii) 		PF00270
(DEAD)
PF00271
(Helicase_C) 		4 PRO A 251
SER A 253
VAL A 254
ARG A 257
 None
 0.90A 4mk4A-2z0mA:
2.8		 4mk4A-2z0mA:
21.45
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) 		7 MET A  99
PRO A 266
SER A 268
VAL A 269
ARG A 272
VAL A 305
GLY A 306
 CHD  A   2 (-4.0A)
CHD  A   2 ( 4.5A)
CHD  A   2 ( 4.4A)
None
FES  A 501 (-4.1A)
CHD  A   1 ( 4.9A)
CHD  A   2 ( 3.8A)
 0.33A 4mk4A-3aqiA:
59.3		 4mk4A-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.
3d2u UL18 PROTEIN

(Human
betaherpesvirus
5) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 PRO A 191
SER A 211
VAL A 193
VAL A 188
 None
 0.98A 4mk4A-3d2uA:
undetectable		 4mk4A-3d2uA:
20.69
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.
3da1 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Bacillus
halodurans) 		PF01266
(DAO)
PF16901
(DAO_C) 		4 SER A  58
ARG A 493
VAL A 253
GLY A 252
 None
None
None
FAD  A 609 (-3.5A)
 0.82A 4mk4A-3da1A:
undetectable		 4mk4A-3da1A:
21.04
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.
3dwz BETA-LACTAMASE

(Mycobacterium
tuberculosis) 		PF13354
(Beta-lactamase2) 		4 SER A 267
VAL A 271
VAL A 305
GLY A 304
 None
 0.97A 4mk4A-3dwzA:
undetectable		 4mk4A-3dwzA:
20.79
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.
3e7n D-RIBOSE
HIGH-AFFINITY
TRANSPORT SYSTEM

(Salmonella
enterica) 		PF05025
(RbsD_FucU) 		4 VAL A  57
ARG A  60
VAL A  48
GLY A  47
 None
 0.95A 4mk4A-3e7nA:
undetectable		 4mk4A-3e7nA:
14.16
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.
3e7w D-ALANINE--POLY(PHOS
PHORIBITOL) LIGASE
SUBUNIT 1

(Bacillus
subtilis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 PRO A 273
SER A 275
VAL A 276
GLY A 435
 None
 0.52A 4mk4A-3e7wA:
3.3		 4mk4A-3e7wA:
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.
3el6 ERYTHROMYCIN
DEHYDRATASE

(Saccharopolyspora
erythraea) 		PF14765
(PS-DH) 		4 PRO A  53
SER A  55
VAL A  56
VAL A  45
 None
 0.75A 4mk4A-3el6A:
undetectable		 4mk4A-3el6A:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3fve DIAMINOPIMELATE
EPIMERASE

(Mycobacterium
tuberculosis) 		PF01678
(DAP_epimerase) 		4 ARG A 141
VAL A 257
VAL A 261
GLY A 246
 None
 1.00A 4mk4A-3fveA:
undetectable		 4mk4A-3fveA:
21.58
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.
3gcw PROPROTEIN
CONVERTASE
SUBTILISIN/KEXIN
TYPE 9

(Homo sapiens) 		PF00082
(Peptidase_S8) 		4 MET A 398
VAL A 284
VAL A 233
GLY A 232
 None
 1.01A 4mk4A-3gcwA:
2.4		 4mk4A-3gcwA:
19.71
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.
3gju PUTATIVE
AMINOTRANSFERASE

(Mesorhizobium
japonicum) 		PF00202
(Aminotran_3) 		4 ARG A  34
SER A 454
VAL A 455
GLY A 416
 None
 0.87A 4mk4A-3gjuA:
undetectable		 4mk4A-3gjuA:
21.53
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.
3h77 PQS BIOSYNTHETIC
ENZYME

(Pseudomonas
aeruginosa) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 MET A  55
PRO A 294
VAL A 295
GLY A 118
 None
 0.85A 4mk4A-3h77A:
2.4		 4mk4A-3h77A:
23.27
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.
3i4j AMINOTRANSFERASE,
CLASS III

(Deinococcus
radiodurans) 		PF00202
(Aminotran_3) 		4 PRO A 406
SER A 408
VAL A  40
GLY A 262
 None
 1.03A 4mk4A-3i4jA:
undetectable		 4mk4A-3i4jA:
21.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ics COENZYME A-DISULFIDE
REDUCTASE

(Bacillus
anthracis) 		PF00581
(Rhodanese)
PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		4 PRO A 438
SER A 434
VAL A 401
GLY A 400
 None
 1.01A 4mk4A-3icsA:
3.4		 4mk4A-3icsA:
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.
3l0z PUTATIVE
NICOTINATE-NUCLEOTID
E-DIMETHYLBENZIMIDAZ
OLE
PHOSPHORIBOSYLTRANSF
ERASE

(Methanocaldococcus
jannaschii) 		PF02277
(DBI_PRT) 		4 PRO A 153
SER A  38
VAL A 317
GLY A 316
 PO4  A 351 (-4.7A)
PO4  A 351 (-2.9A)
None
None
 0.98A 4mk4A-3l0zA:
2.4		 4mk4A-3l0zA:
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.
3lhe GNTR FAMILY
TRANSCRIPTIONAL
REGULATOR

(Bacillus
anthracis) 		PF07702
(UTRA) 		4 PRO A 148
SER A 150
VAL A 151
GLY A 109
 CL  A 233 ( 4.7A)
CL  A 233 (-3.2A)
None
None
 0.92A 4mk4A-3lheA:
undetectable		 4mk4A-3lheA:
16.16
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.
3ljp CHOLINE OXIDASE

(Arthrobacter
globiformis) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		4 SER A 501
VAL A 471
VAL A  19
GLY A  20
 None
None
None
FDA  A 547 (-3.2A)
 0.76A 4mk4A-3ljpA:
undetectable		 4mk4A-3ljpA:
21.22
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.
3llc PUTATIVE HYDROLASE

(Agrobacterium
vitis) 		PF12697
(Abhydrolase_6) 		4 ARG A 250
VAL A 140
VAL A 241
GLY A 213
 None
 0.92A 4mk4A-3llcA:
4.6		 4mk4A-3llcA:
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.
3lrv PRE-MRNA-SPLICING
FACTOR 19

(Saccharomyces
cerevisiae) 		no annotation 4 PRO A 196
VAL A 210
VAL A 337
GLY A 336
 None
 0.93A 4mk4A-3lrvA:
undetectable		 4mk4A-3lrvA:
22.28
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.
3m07 PUTATIVE ALPHA
AMYLASE

(Salmonella
enterica) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		4 ARG A 540
PRO A 382
VAL A 383
GLY A 525
 None
 1.02A 4mk4A-3m07A:
undetectable		 4mk4A-3m07A:
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.
3m49 TRANSKETOLASE

(Bacillus
anthracis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 MET A 589
VAL A 603
VAL A 626
GLY A 627
 None
FMT  A 715 (-4.9A)
None
None
 0.99A 4mk4A-3m49A:
undetectable		 4mk4A-3m49A:
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.
3mdn GLUTAMINE
AMINOTRANSFERASE
CLASS-II DOMAIN
PROTEIN

(Ruegeria
pomeroyi) 		PF13230
(GATase_4) 		4 SER A 224
VAL A 223
VAL A  46
GLY A  45
 None
 0.98A 4mk4A-3mdnA:
undetectable		 4mk4A-3mdnA:
20.21
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.
3mfd D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACB

(Bacillus
subtilis) 		PF00768
(Peptidase_S11)
PF07943
(PBP5_C) 		4 SER A  83
VAL A  82
VAL A 127
GLY A 128
 None
 0.74A 4mk4A-3mfdA:
undetectable		 4mk4A-3mfdA:
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.
3nv0 NUCLEAR RNA EXPORT
FACTOR 2
NTF2-RELATED EXPORT
PROTEIN

(Caenorhabditis
elegans;
Caenorhabditis
elegans) 		no annotation
PF02136
(NTF2) 		4 PRO B  84
SER A 377
VAL A 376
GLY B  93
 None
None
None
NA  B 455 (-3.5A)
 0.99A 4mk4A-3nv0B:
undetectable		 4mk4A-3nv0B:
17.33
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.
3nv0 NUCLEAR RNA EXPORT
FACTOR 2
NTF2-RELATED EXPORT
PROTEIN

(Caenorhabditis
elegans;
Caenorhabditis
elegans) 		no annotation
PF02136
(NTF2) 		4 PRO B  84
SER A 377
VAL A 376
GLY B  94
 None
 0.77A 4mk4A-3nv0B:
undetectable		 4mk4A-3nv0B:
17.33
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.
3o12 UNCHARACTERIZED
PROTEIN YJL217W

(Saccharomyces
cerevisiae) 		PF07081
(DUF1349) 		4 ARG A  84
PRO A  18
VAL A  21
GLY A  51
 None
 0.94A 4mk4A-3o12A:
undetectable		 4mk4A-3o12A:
24.13
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.
3oa2 WBPB

(Pseudomonas
aeruginosa) 		PF01408
(GFO_IDH_MocA)
PF02894
(GFO_IDH_MocA_C) 		4 ARG A 225
PRO A 236
SER A 238
VAL A 239
 None
 0.97A 4mk4A-3oa2A:
2.3		 4mk4A-3oa2A:
21.99
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.
3oec CARVEOL
DEHYDROGENASE
(MYTHA.01326.C,
A0R518 HOMOLOG)

(Mycolicibacterium
thermoresistibile) 		PF13561
(adh_short_C2) 		4 PRO A 216
VAL A 265
VAL A 175
GLY A 176
 None
 0.64A 4mk4A-3oecA:
3.0		 4mk4A-3oecA:
21.83
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.
3pe7 OLIGOGALACTURONATE
LYASE

(Yersinia
enterocolitica) 		PF14583
(Pectate_lyase22) 		4 PRO A 383
SER A 385
VAL A 386
GLY A  20
 None
 0.73A 4mk4A-3pe7A:
undetectable		 4mk4A-3pe7A:
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.
3qvl PUTATIVE HYDANTOIN
RACEMASE

(Klebsiella
pneumoniae) 		PF01177
(Asp_Glu_race) 		4 PRO A  83
SER A  79
VAL A  58
GLY A  59
 None
5HY  A   1 (-3.1A)
None
None
 0.95A 4mk4A-3qvlA:
3.7		 4mk4A-3qvlA:
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.
3r31 BETAINE ALDEHYDE
DEHYDROGENASE

(Agrobacterium
fabrum) 		PF00171
(Aldedh) 		4 MET A 319
PRO A 364
VAL A 367
GLY A 361
 None
 1.00A 4mk4A-3r31A:
2.2		 4mk4A-3r31A:
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.
3rbl AROMATIC L-AMINO
ACID DECARBOXYLASE

(Homo sapiens) 		PF00282
(Pyridoxal_deC) 		4 ARG A 285
VAL A 240
VAL A 291
GLY A 290
 None
 1.00A 4mk4A-3rblA:
4.2		 4mk4A-3rblA:
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.
3sjn MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 SER A 312
VAL A 313
VAL A  41
GLY A  42
 None
 0.99A 4mk4A-3sjnA:
undetectable		 4mk4A-3sjnA:
21.84
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.
3sql GLYCOSYL HYDROLASE
FAMILY 3

(Synechococcus
sp. PCC 7002) 		PF00933
(Glyco_hydro_3) 		4 ARG A 217
VAL A 237
VAL A 150
GLY A 198
 None
 0.99A 4mk4A-3sqlA:
3.6		 4mk4A-3sqlA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ulk KETOL-ACID
REDUCTOISOMERASE

(Escherichia
coli) 		PF01450
(IlvC)
PF07991
(IlvN) 		4 PRO A 154
SER A 131
VAL A 152
GLY A 158
 PRO  A 154 (-1.1A)
SER  A 131 (-0.0A)
VAL  A 152 ( 0.6A)
GLY  A 158 ( 0.0A)
 0.96A 4mk4A-3ulkA:
2.9		 4mk4A-3ulkA:
21.44
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.
3us8 ISOCITRATE
DEHYDROGENASE [NADP]

(Sinorhizobium
meliloti) 		PF00180
(Iso_dh) 		4 PRO A  95
ARG A 100
VAL A  46
GLY A  45
 SO4  A 501 ( 4.7A)
SO4  A 501 ( 4.8A)
None
None
 0.65A 4mk4A-3us8A:
4.1		 4mk4A-3us8A:
20.68
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.
3vly NITRITE REDUCTASE

(Nicotiana
tabacum) 		PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr) 		4 PRO A 227
VAL A 178
VAL A 229
GLY A 183
 None
 0.90A 4mk4A-3vlyA:
2.0		 4mk4A-3vlyA:
20.59
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.
3wgk CELL DIVISION
PROTEIN FTSZ

(Staphylococcus
aureus) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		4 MET A 224
ARG A 191
VAL A 280
VAL A 305
 None
 1.03A 4mk4A-3wgkA:
4.1		 4mk4A-3wgkA:
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.
3zif PENTON PROTEIN

(Bovine
mastadenovirus
B) 		PF01686
(Adeno_Penton_B) 		4 PRO M 383
SER M 426
VAL M 345
GLY M 344
 None
 0.84A 4mk4A-3zifM:
undetectable		 4mk4A-3zifM:
22.81
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.
3zx1 OXIDOREDUCTASE,
PUTATIVE

(Campylobacter
jejuni) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		4 MET A 217
VAL A 246
VAL A 191
GLY A 194
 None
 0.90A 4mk4A-3zx1A:
undetectable		 4mk4A-3zx1A:
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.
4a0s OCTENOYL-COA
REDUCTASE/CARBOXYLAS
E

(Streptomyces
cinnabarigriseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		4 PRO A 382
SER A 199
VAL A 198
GLY A 378
 None
 0.98A 4mk4A-4a0sA:
undetectable		 4mk4A-4a0sA:
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.
4atw ALPHA-L-ARABINOFURAN
OSIDASE DOMAIN
PROTEIN

(Thermotoga
maritima) 		PF06964
(Alpha-L-AF_C) 		4 PRO A 320
SER A  17
VAL A 275
GLY A 274
 None
 0.97A 4mk4A-4atwA:
undetectable		 4mk4A-4atwA:
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.
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobacter
marburgensis;
Methanothermobacter
marburgensis) 		PF00374
(NiFeSe_Hases)
PF04422
(FrhB_FdhB_N)
PF04432
(FrhB_FdhB_C) 		4 SER A 152
ARG A 155
VAL C 119
GLY C 118
 None
 0.97A 4mk4A-4ci0A:
undetectable		 4mk4A-4ci0A:
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.
4ci6 PROTEIN KINASE YOPO

(Yersinia
enterocolitica) 		PF00069
(Pkinase)
PF09632
(Rac1) 		4 PRO B 297
SER B 291
VAL B 311
GLY B 312
 None
 1.03A 4mk4A-4ci6B:
undetectable		 4mk4A-4ci6B:
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.
4cql ESTRADIOL
17-BETA-DEHYDROGENAS
E 8

(Homo sapiens) 		PF13561
(adh_short_C2) 		4 PRO A 199
VAL A 233
VAL A 158
GLY A 159
 None
 0.82A 4mk4A-4cqlA:
3.7		 4mk4A-4cqlA:
23.74
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.
4cqm CARBONYL REDUCTASE
FAMILY MEMBER 4

(Homo sapiens) 		PF13561
(adh_short_C2) 		4 PRO B 178
VAL B 209
VAL B 137
GLY B 138
 NAP  B 301 (-4.5A)
None
None
None
 0.72A 4mk4A-4cqmB:
3.8		 4mk4A-4cqmB:
19.67
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.
4doo CHALCONE-FLAVANONE
ISOMERASE FAMILY
PROTEIN

(Arabidopsis
thaliana) 		PF16035
(Chalcone_2) 		4 VAL A  94
ARG A 142
VAL A  27
GLY A  46
 None
 1.01A 4mk4A-4dooA:
undetectable		 4mk4A-4dooA:
18.33
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.
4gqb PROTEIN ARGININE
N-METHYLTRANSFERASE
5

(Homo sapiens) 		PF05185
(PRMT5)
PF17285
(PRMT5_TIM)
PF17286
(PRMT5_C) 		4 PRO A 620
VAL A 621
VAL A 542
GLY A 595
 None
 1.02A 4mk4A-4gqbA:
undetectable		 4mk4A-4gqbA:
20.28