SIMILAR PATTERNS OF AMINO ACIDS FOR 1CMA_A_SAMA105_0

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.
1brw PROTEIN (PYRIMIDINE
NUCLEOSIDE
PHOSPHORYLASE)

(Geobacillus
stearothermophilus) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		4 GLU A 297
ARG A 293
GLU A 270
HIS A 266
 None
 0.68A 1cmaA-1brwA:
undetectable
1cmaB-1brwA:
undetectable		 1cmaA-1brwA:
15.64
1cmaB-1brwA:
15.64
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.
1hc7 PROLYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09180
(ProRS-C_1) 		4 GLU A 391
ARG A 394
ARG A 395
LEU A 366
 None
 0.86A 1cmaA-1hc7A:
undetectable
1cmaB-1hc7A:
undetectable		 1cmaA-1hc7A:
12.18
1cmaB-1hc7A:
12.18
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.
1hlv MAJOR CENTROMERE
AUTOANTIGEN B

(Homo sapiens) 		PF03221
(HTH_Tnp_Tc5)
PF04218
(CENP-B_N) 		4 GLU A  30
ARG A  33
ARG A  34
LEU A  26
 None
 0.98A 1cmaA-1hlvA:
undetectable
1cmaB-1hlvA:
undetectable		 1cmaA-1hlvA:
24.24
1cmaB-1hlvA:
24.24
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.
1m7h ADENYLYLSULFATE
KINASE

(Penicillium
chrysogenum) 		PF01583
(APS_kinase) 		4 GLU A  82
ARG A  85
ARG A  86
LEU A  73
 None
 0.85A 1cmaA-1m7hA:
undetectable
1cmaB-1m7hA:
undetectable		 1cmaA-1m7hA:
19.51
1cmaB-1m7hA:
19.51
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1mjl METHIONINE REPRESSOR
PROTEIN METJ

(Escherichia
coli) 		PF01340
(MetJ) 		7 GLU A  39
ARG A  42
ARG A  43
LEU A  56
GLU A  59
HIS A  63
LEU A  70
 None
None
None
None
None
SAM  A 200 ( 2.9A)
None
 0.40A 1cmaA-1mjlA:
17.4
1cmaB-1mjlA:
15.5		 1cmaA-1mjlA:
99.04
1cmaB-1mjlA:
99.04
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.
1o5w AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Rattus
norvegicus) 		PF01593
(Amino_oxidase) 		4 GLU A  34
LEU A  31
GLU A 453
LEU A  80
 None
 0.99A 1cmaA-1o5wA:
undetectable
1cmaB-1o5wA:
undetectable		 1cmaA-1o5wA:
11.01
1cmaB-1o5wA:
11.01
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.
1pko MYELIN
OLIGODENDROCYTE
GLYCOPROTEIN

(Rattus
norvegicus) 		PF07686
(V-set) 		5 GLU A  36
ARG A 101
ARG A  52
LEU A  50
GLU A  60
 None
 1.16A 1cmaA-1pkoA:
undetectable
1cmaB-1pkoA:
undetectable		 1cmaA-1pkoA:
23.57
1cmaB-1pkoA:
23.57
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.
1vs0 PUTATIVE DNA
LIGASE-LIKE PROTEIN
RV0938/MT0965

(Mycobacterium
tuberculosis) 		PF01068
(DNA_ligase_A_M)
PF04679
(DNA_ligase_A_C) 		4 PHE A 559
LEU A 581
GLU A 582
LEU A 595
 APK  A 481 ( 3.4A)
None
None
None
 1.06A 1cmaA-1vs0A:
undetectable
1cmaB-1vs0A:
undetectable		 1cmaA-1vs0A:
15.86
1cmaB-1vs0A:
15.86
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.
1wcx UROPORPHYRINOGEN III
SYNTHASE

(Thermus
thermophilus) 		PF02602
(HEM4) 		4 GLU A 183
ARG A 181
LEU A  34
LEU A 175
 None
 0.93A 1cmaA-1wcxA:
undetectable
1cmaB-1wcxA:
undetectable		 1cmaA-1wcxA:
17.31
1cmaB-1wcxA:
17.31
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.
1x1o NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE

(Thermus
thermophilus) 		PF01729
(QRPTase_C)
PF02749
(QRPTase_N) 		4 GLU A 232
ARG A 235
ARG A 236
LEU A 206
 None
 0.81A 1cmaA-1x1oA:
undetectable
1cmaB-1x1oA:
undetectable		 1cmaA-1x1oA:
18.68
1cmaB-1x1oA:
18.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xdp POLYPHOSPHATE KINASE

(Escherichia
coli) 		PF02503
(PP_kinase)
PF13089
(PP_kinase_N)
PF13090
(PP_kinase_C) 		4 GLU A 462
ARG A 381
LEU A 354
GLU A 351
 None
 1.01A 1cmaA-1xdpA:
undetectable
1cmaB-1xdpA:
undetectable		 1cmaA-1xdpA:
9.53
1cmaB-1xdpA:
9.53
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.
1xnj BIFUNCTIONAL
3'-PHOSPHOADENOSINE
5'-PHOSPHOSULFATE
SYNTHETASE 1

(Homo sapiens) 		no annotation 4 GLU B 108
ARG B 111
ARG B 112
LEU B  99
 None
 0.87A 1cmaA-1xnjB:
undetectable
1cmaB-1xnjB:
undetectable		 1cmaA-1xnjB:
11.02
1cmaB-1xnjB:
11.02
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.
1y79 PEPTIDYL-DIPEPTIDASE
DCP

(Escherichia
coli) 		PF01432
(Peptidase_M3) 		4 GLU 1 130
LEU 1 134
GLU 1  62
LEU 1 435
 None
 1.07A 1cmaA-1y791:
undetectable
1cmaB-1y791:
undetectable		 1cmaA-1y791:
9.01
1cmaB-1y791:
9.01
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.
2a5y APOPTOSIS REGULATOR
CED-9

(Caenorhabditis
elegans) 		PF00452
(Bcl-2)
PF02180
(BH4) 		4 GLU A  75
ARG A  77
LEU A  78
GLU A 112
 None
 1.01A 1cmaA-2a5yA:
undetectable
1cmaB-2a5yA:
undetectable		 1cmaA-2a5yA:
17.20
1cmaB-2a5yA:
17.20
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.
2bbe HYPOTHETICAL PROTEIN
SO0527

(Shewanella
oneidensis) 		PF03992
(ABM) 		4 GLU A  58
ARG A  60
LEU A  21
GLU A  96
 None
 0.95A 1cmaA-2bbeA:
undetectable
1cmaB-2bbeA:
undetectable		 1cmaA-2bbeA:
19.63
1cmaB-2bbeA:
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.
2e6k TRANSKETOLASE

(Thermus
thermophilus) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLU A 326
ARG A 329
ARG A 330
GLU A 140
 None
 0.93A 1cmaA-2e6kA:
undetectable
1cmaB-2e6kA:
undetectable		 1cmaA-2e6kA:
11.08
1cmaB-2e6kA:
11.08
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.
2fbq PROBABLE
TRANSCRIPTIONAL
REGULATOR

(Pseudomonas
aeruginosa) 		PF00440
(TetR_N) 		4 GLU A  71
ARG A  74
ARG A  75
LEU A  92
 None
 0.81A 1cmaA-2fbqA:
undetectable
1cmaB-2fbqA:
undetectable		 1cmaA-2fbqA:
20.75
1cmaB-2fbqA:
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.
2gee HYPOTHETICAL PROTEIN

(Homo sapiens) 		PF00041
(fn3) 		4 GLU A 231
ARG A 219
LEU A 217
GLU A 264
 None
 0.79A 1cmaA-2geeA:
undetectable
1cmaB-2geeA:
undetectable		 1cmaA-2geeA:
17.93
1cmaB-2geeA:
17.93
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.
2gou OXIDOREDUCTASE,
FMN-BINDING

(Shewanella
oneidensis) 		PF00724
(Oxidored_FMN) 		4 ARG A  29
LEU A 357
HIS A 344
LEU A 349
 None
None
None
FMN  A4401 ( 3.8A)
 0.90A 1cmaA-2gouA:
undetectable
1cmaB-2gouA:
undetectable		 1cmaA-2gouA:
14.25
1cmaB-2gouA:
14.25
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.
2guz MITOCHONDRIAL IMPORT
INNER MEMBRANE
TRANSLOCASE SUBUNIT
TIM16

(Saccharomyces
cerevisiae) 		PF03656
(Pam16) 		4 GLU B 111
ARG B 115
LEU B  71
GLU B  66
 None
 1.05A 1cmaA-2guzB:
undetectable
1cmaB-2guzB:
undetectable		 1cmaA-2guzB:
18.95
1cmaB-2guzB:
18.95
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.
2hi0 PUTATIVE
PHOSPHOGLYCOLATE
PHOSPHATASE

(Lactobacillus
delbrueckii) 		PF13419
(HAD_2) 		4 GLU A  88
ARG A  91
LEU A  59
GLU A  62
 None
 0.54A 1cmaA-2hi0A:
undetectable
1cmaB-2hi0A:
undetectable		 1cmaA-2hi0A:
17.11
1cmaB-2hi0A:
17.11
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.
2ivd PROTOPORPHYRINOGEN
OXIDASE

(Myxococcus
xanthus) 		PF01593
(Amino_oxidase) 		4 GLU A 389
ARG A 339
ARG A 340
LEU A 385
 None
 0.95A 1cmaA-2ivdA:
undetectable
1cmaB-2ivdA:
undetectable		 1cmaA-2ivdA:
11.75
1cmaB-2ivdA:
11.75
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.
2j1o GERANYLGERANYL
PYROPHOSPHATE
SYNTHETASE

(Sinapis alba) 		PF00348
(polyprenyl_synt) 		4 GLU A 198
ARG A 223
ARG A 219
GLU A 152
 GOL  A1305 (-2.8A)
GOL  A1305 (-4.3A)
None
None
 0.80A 1cmaA-2j1oA:
undetectable
1cmaB-2j1oA:
undetectable		 1cmaA-2j1oA:
14.89
1cmaB-2j1oA:
14.89
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.
2o03 PROBABLE ZINC UPTAKE
REGULATION PROTEIN
FURB

(Mycobacterium
tuberculosis) 		PF01475
(FUR) 		4 GLU A  35
ARG A  38
ARG A  39
LEU A  19
 None
 0.88A 1cmaA-2o03A:
undetectable
1cmaB-2o03A:
undetectable		 1cmaA-2o03A:
22.73
1cmaB-2o03A:
22.73
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.
2o7q BIFUNCTIONAL
3-DEHYDROQUINATE
DEHYDRATASE/SHIKIMAT
E DEHYDROGENASE

(Arabidopsis
thaliana) 		PF01487
(DHquinase_I)
PF01488
(Shikimate_DH)
PF08501
(Shikimate_dh_N) 		4 GLU A 167
ARG A 170
ARG A 171
GLU A 194
 None
 1.01A 1cmaA-2o7qA:
undetectable
1cmaB-2o7qA:
undetectable		 1cmaA-2o7qA:
11.84
1cmaB-2o7qA:
11.84
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.
2ofx BIFUNCTIONAL
3'-PHOSPHOADENOSINE
5'-PHOSPHOSULFATE
SYNTHETASE 1

(Homo sapiens) 		PF01583
(APS_kinase) 		4 GLU A 108
ARG A 111
ARG A 112
LEU A  99
 None
 0.91A 1cmaA-2ofxA:
undetectable
1cmaB-2ofxA:
undetectable		 1cmaA-2ofxA:
19.81
1cmaB-2ofxA:
19.81
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.
2pey BIFUNCTIONAL
3'-PHOSPHOADENOSINE
5'-PHOSPHOSULFATE
SYNTHETASE 1 (PAPS
SYNTHETASE 1) (PAPSS
1) (SULFURYLASE
KINASE 1) (SK1) (SK
1)

(Homo sapiens) 		PF01583
(APS_kinase) 		4 GLU A 108
ARG A 111
ARG A 112
LEU A  99
 None
 0.90A 1cmaA-2peyA:
undetectable
1cmaB-2peyA:
undetectable		 1cmaA-2peyA:
22.78
1cmaB-2peyA:
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.
2q6t DNAB REPLICATION
FORK HELICASE

(Thermus
aquaticus) 		PF00772
(DnaB)
PF03796
(DnaB_C) 		4 ARG A 157
LEU A 162
GLU A 165
HIS A 169
 None
 0.67A 1cmaA-2q6tA:
undetectable
1cmaB-2q6tA:
undetectable		 1cmaA-2q6tA:
14.15
1cmaB-2q6tA:
14.15
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.
2rkh PUTATIVE APHA-LIKE
TRANSCRIPTION FACTOR

(Magnetospirillum
magnetotacticum) 		PF14557
(AphA_like) 		4 GLU A  87
ARG A  14
LEU A  62
GLU A  60
 None
 0.89A 1cmaA-2rkhA:
undetectable
1cmaB-2rkhA:
undetectable		 1cmaA-2rkhA:
20.67
1cmaB-2rkhA:
20.67
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.
2wac CG7008-PA

(Drosophila
melanogaster) 		PF00567
(TUDOR) 		4 GLU A 830
ARG A 833
LEU A 879
GLU A 877
 None
 0.99A 1cmaA-2wacA:
undetectable
1cmaB-2wacA:
undetectable		 1cmaA-2wacA:
19.72
1cmaB-2wacA:
19.72
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.
2wtk STE20-RELATED KINASE
ADAPTER PROTEIN
ALPHA

(Homo sapiens) 		PF00069
(Pkinase) 		4 PHE B 355
LEU B 360
HIS B 353
LEU B 299
 None
 1.00A 1cmaA-2wtkB:
undetectable
1cmaB-2wtkB:
undetectable		 1cmaA-2wtkB:
13.40
1cmaB-2wtkB:
13.40
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.
2yzm D-ALANINE--D-ALANINE
LIGASE

(Thermus
thermophilus) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		4 GLU A 308
ARG A 311
ARG A 312
GLU A 209
 None
 1.07A 1cmaA-2yzmA:
undetectable
1cmaB-2yzmA:
undetectable		 1cmaA-2yzmA:
16.67
1cmaB-2yzmA:
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.
2z5x AMINE OXIDASE
[FLAVIN-CONTAINING]
A

(Homo sapiens) 		PF01593
(Amino_oxidase) 		4 GLU A  34
LEU A  31
GLU A 453
LEU A  80
 None
 0.99A 1cmaA-2z5xA:
undetectable
1cmaB-2z5xA:
undetectable		 1cmaA-2z5xA:
12.20
1cmaB-2z5xA:
12.20
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.
2zxo SINGLE-STRANDED DNA
SPECIFIC EXONUCLEASE
RECJ

(Thermus
thermophilus) 		PF01368
(DHH)
PF02272
(DHHA1) 		4 GLU A 548
ARG A 552
LEU A 544
GLU A 602
 None
 0.93A 1cmaA-2zxoA:
undetectable
1cmaB-2zxoA:
undetectable		 1cmaA-2zxoA:
9.67
1cmaB-2zxoA:
9.67
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.
3afe HYDROXYLASE,
PUTATIVE

(Mycobacterium
tuberculosis) 		PF02771
(Acyl-CoA_dh_N)
PF08028
(Acyl-CoA_dh_2) 		4 GLU A  70
ARG A  73
ARG A  74
LEU A  13
 None
 0.86A 1cmaA-3afeA:
undetectable
1cmaB-3afeA:
undetectable		 1cmaA-3afeA:
13.21
1cmaB-3afeA:
13.21
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.
3auo DNA POLYMERASE BETA
FAMILY (X FAMILY)

(Thermus
thermophilus) 		PF14520
(HHH_5)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb) 		4 GLU A 184
ARG A 190
LEU A 256
GLU A 297
 None
 0.94A 1cmaA-3auoA:
undetectable
1cmaB-3auoA:
undetectable		 1cmaA-3auoA:
11.69
1cmaB-3auoA:
11.69
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.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		4 ARG A 166
ARG A 167
LEU A 159
GLU A 157
 None
 0.80A 1cmaA-3bo5A:
undetectable
1cmaB-3bo5A:
undetectable		 1cmaA-3bo5A:
14.44
1cmaB-3bo5A:
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.
3bo5 HISTONE-LYSINE
N-METHYLTRANSFERASE
SETMAR

(Homo sapiens) 		PF00856
(SET)
PF05033
(Pre-SET) 		4 GLU A 163
ARG A 166
ARG A 167
GLU A 157
 None
 0.70A 1cmaA-3bo5A:
undetectable
1cmaB-3bo5A:
undetectable		 1cmaA-3bo5A:
14.44
1cmaB-3bo5A:
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.
3cr8 SULFATE
ADENYLYLTRANSFERASE,
ADENYLYLSULFATE
KINASE

(Thiobacillus
denitrificans) 		PF01583
(APS_kinase)
PF01747
(ATP-sulfurylase)
PF14306
(PUA_2) 		4 GLU A 334
ARG A 337
ARG A 338
LEU A 330
 None
 0.67A 1cmaA-3cr8A:
undetectable
1cmaB-3cr8A:
undetectable		 1cmaA-3cr8A:
10.48
1cmaB-3cr8A:
10.48
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.
3d36 SPORULATION KINASE B

(Geobacillus
stearothermophilus) 		PF00512
(HisKA)
PF02518
(HATPase_c) 		4 ARG A 282
ARG A 311
LEU A 274
GLU A 272
 None
 0.96A 1cmaA-3d36A:
undetectable
1cmaB-3d36A:
undetectable		 1cmaA-3d36A:
18.18
1cmaB-3d36A:
18.18
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.
3dm5 SIGNAL RECOGNITION
54 KDA PROTEIN

(Pyrococcus
furiosus) 		PF00448
(SRP54)
PF02881
(SRP54_N)
PF02978
(SRP_SPB) 		4 GLU A  55
ARG A  58
ARG A  59
GLU A  81
 None
 0.89A 1cmaA-3dm5A:
undetectable
1cmaB-3dm5A:
undetectable		 1cmaA-3dm5A:
14.02
1cmaB-3dm5A:
14.02
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.
3efz 14-3-3 PROTEIN

(Cryptosporidium
parvum) 		PF00244
(14-3-3) 		4 GLU A 157
ARG A  79
LEU A 209
LEU A 263
 None
SEP  A 265 ( 3.2A)
None
None
 0.96A 1cmaA-3efzA:
undetectable
1cmaB-3efzA:
undetectable		 1cmaA-3efzA:
19.46
1cmaB-3efzA:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gfm 146AA LONG
HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR

(Sulfurisphaera
tokodaii) 		PF13463
(HTH_27) 		4 GLU A  25
ARG A  28
LEU A 114
GLU A 117
 None
 1.01A 1cmaA-3gfmA:
undetectable
1cmaB-3gfmA:
undetectable		 1cmaA-3gfmA:
20.27
1cmaB-3gfmA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h4c TRANSCRIPTION FACTOR
TFIIB-LIKE

(Trypanosoma
brucei) 		no annotation 4 GLU A 156
ARG A 120
LEU A 196
GLU A 193
 None
 0.93A 1cmaA-3h4cA:
undetectable
1cmaB-3h4cA:
undetectable		 1cmaA-3h4cA:
16.03
1cmaB-3h4cA:
16.03
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.
3jr2 HEXULOSE-6-PHOSPHATE
SYNTHASE SGBH

(Vibrio cholerae) 		PF00215
(OMPdecase) 		4 GLU A  78
ARG A  74
LEU A 105
GLU A 104
 None
 0.99A 1cmaA-3jr2A:
undetectable
1cmaB-3jr2A:
undetectable		 1cmaA-3jr2A:
18.10
1cmaB-3jr2A:
18.10
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.
3juw PROBABLE GNAT-FAMILY
ACETYLTRANSFERASE

(Bordetella
pertussis) 		PF13302
(Acetyltransf_3) 		4 ARG A  86
LEU A 135
GLU A  97
HIS A  95
 SO4  A 306 (-3.8A)
None
None
None
 0.87A 1cmaA-3juwA:
undetectable
1cmaB-3juwA:
1.4		 1cmaA-3juwA:
18.78
1cmaB-3juwA:
18.78
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.
3k3n PHD FINGER PROTEIN 8

(Homo sapiens) 		PF02373
(JmjC) 		4 GLU A 436
ARG A 383
ARG A 380
LEU A 376
 None
 1.07A 1cmaA-3k3nA:
undetectable
1cmaB-3k3nA:
undetectable		 1cmaA-3k3nA:
14.63
1cmaB-3k3nA:
14.63
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.
3lop SUBSTRATE BINDING
PERIPLASMIC PROTEIN

(Ralstonia
solanacearum) 		PF13458
(Peripla_BP_6) 		4 GLU A 328
ARG A 331
ARG A 332
LEU A 349
 None
 0.83A 1cmaA-3lopA:
undetectable
1cmaB-3lopA:
undetectable		 1cmaA-3lopA:
15.31
1cmaB-3lopA:
15.31
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.
3npi TETR FAMILY
REGULATORY PROTEIN

(Corynebacterium
diphtheriae) 		PF00440
(TetR_N) 		4 GLU A  71
ARG A  74
ARG A  75
LEU A  27
 None
SO4  A 257 (-2.8A)
None
None
 0.75A 1cmaA-3npiA:
undetectable
1cmaB-3npiA:
undetectable		 1cmaA-3npiA:
19.34
1cmaB-3npiA:
19.34
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.
3o0p SORTASE FAMILY
PROTEIN

(Streptococcus
agalactiae) 		PF04203
(Sortase) 		4 GLU A  62
ARG A  65
ARG A  66
LEU A  58
 None
 0.93A 1cmaA-3o0pA:
undetectable
1cmaB-3o0pA:
undetectable		 1cmaA-3o0pA:
19.02
1cmaB-3o0pA:
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.
3qbw ANHYDRO-N-ACETYLMURA
MIC ACID KINASE

(Pseudomonas
aeruginosa) 		PF03702
(AnmK) 		4 GLU A 267
ARG A 302
ARG A 271
LEU A 219
 None
 0.94A 1cmaA-3qbwA:
undetectable
1cmaB-3qbwA:
undetectable		 1cmaA-3qbwA:
15.79
1cmaB-3qbwA:
15.79
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.
3qwu DNA LIGASE

(Aquifex
aeolicus) 		PF09414
(RNA_ligase) 		4 GLU A 344
ARG A 333
ARG A 342
GLU A 134
 None
 0.88A 1cmaA-3qwuA:
undetectable
1cmaB-3qwuA:
undetectable		 1cmaA-3qwuA:
18.09
1cmaB-3qwuA:
18.09
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.
3t6p BACULOVIRAL IAP
REPEAT-CONTAINING
PROTEIN 2

(Homo sapiens) 		PF00619
(CARD)
PF00653
(BIR)
PF13920
(zf-C3HC4_3) 		4 GLU A 560
ARG A 563
ARG A 564
GLU A 551
 None
 0.87A 1cmaA-3t6pA:
undetectable
1cmaB-3t6pA:
1.3		 1cmaA-3t6pA:
14.58
1cmaB-3t6pA:
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.
3tac LIPRIN-ALPHA-2

(Homo sapiens) 		PF00536
(SAM_1)
PF07647
(SAM_2) 		4 GLU B1090
ARG B1093
ARG B1094
LEU B1084
 None
None
SO4  B   5 (-2.8A)
SO4  B   5 (-4.7A)
 1.05A 1cmaA-3tacB:
undetectable
1cmaB-3tacB:
undetectable		 1cmaA-3tacB:
16.51
1cmaB-3tacB:
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.
3toy MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN

(Bradyrhizobium
sp. ORS 278) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		4 GLU A 205
ARG A 208
ARG A 209
LEU A 201
 None
 0.92A 1cmaA-3toyA:
undetectable
1cmaB-3toyA:
undetectable		 1cmaA-3toyA:
15.49
1cmaB-3toyA:
15.49
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.
3uk1 TRANSKETOLASE

(Burkholderia
thailandensis) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLU A 343
ARG A 346
ARG A 347
GLU A 156
 None
 0.92A 1cmaA-3uk1A:
undetectable
1cmaB-3uk1A:
undetectable		 1cmaA-3uk1A:
9.71
1cmaB-3uk1A:
9.71
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.
3w1h L-SERYL-TRNA(SEC)
SELENIUM TRANSFERASE

(Aquifex
aeolicus) 		PF03841
(SelA) 		4 GLU A 406
ARG A 409
ARG A 410
LEU A 402
 None
 0.85A 1cmaA-3w1hA:
undetectable
1cmaB-3w1hA:
undetectable		 1cmaA-3w1hA:
12.53
1cmaB-3w1hA:
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.
4b3i FATTY ACID
BETA-OXIDATION
COMPLEX BETA-CHAIN
FADA

(Mycobacterium
tuberculosis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		4 GLU C 375
ARG C 378
ARG C 379
LEU C 323
 None
SO4  C1411 (-3.7A)
None
None
 0.84A 1cmaA-4b3iC:
undetectable
1cmaB-4b3iC:
undetectable		 1cmaA-4b3iC:
17.70
1cmaB-4b3iC:
17.70
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.
4beq ALANINE RACEMASE 2

(Vibrio cholerae) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 GLU A 138
ARG A 119
LEU A 149
LEU A 132
 None
 0.93A 1cmaA-4beqA:
undetectable
1cmaB-4beqA:
undetectable		 1cmaA-4beqA:
15.71
1cmaB-4beqA:
15.71
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.
4bf7 ARABINOGALACTAN
ENDO-1,4-BETA-GALACT
OSIDASE A

(Aspergillus
nidulans) 		PF07745
(Glyco_hydro_53) 		4 GLU A  64
ARG A  68
LEU A  13
GLU A  16
 None
ACT  A1337 ( 3.8A)
ACT  A1337 ( 3.4A)
ACT  A1337 (-3.1A)
 0.77A 1cmaA-4bf7A:
undetectable
1cmaB-4bf7A:
undetectable		 1cmaA-4bf7A:
16.08
1cmaB-4bf7A:
16.08
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.
4bzx BIFUNCTIONAL ENZYME
CYSN/CYSC

(Mycobacterium
tuberculosis) 		PF01583
(APS_kinase) 		4 GLU A 499
ARG A 502
ARG A 503
LEU A 490
 None
EDO  A1618 (-3.8A)
None
None
 0.83A 1cmaA-4bzxA:
undetectable
1cmaB-4bzxA:
undetectable		 1cmaA-4bzxA:
21.93
1cmaB-4bzxA:
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.
4c22 L-FUCOSE ISOMERASE

(Streptococcus
pneumoniae) 		PF02952
(Fucose_iso_C)
PF07881
(Fucose_iso_N1)
PF07882
(Fucose_iso_N2) 		4 GLU A 210
ARG A 213
ARG A 214
LEU A 271
 None
 0.74A 1cmaA-4c22A:
undetectable
1cmaB-4c22A:
undetectable		 1cmaA-4c22A:
11.88
1cmaB-4c22A:
11.88
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.
4ffc 4-AMINOBUTYRATE
AMINOTRANSFERASE
(GABT)

(Mycobacteroides
abscessus) 		PF00202
(Aminotran_3) 		4 GLU A 204
ARG A 208
LEU A 200
GLU A 197
 None
 0.66A 1cmaA-4ffcA:
undetectable
1cmaB-4ffcA:
undetectable		 1cmaA-4ffcA:
13.01
1cmaB-4ffcA:
13.01
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.
4fxp ADENYLYL-SULFATE
KINASE 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF01583
(APS_kinase) 		4 GLU A 157
ARG A 160
ARG A 161
LEU A 148
 None
 0.85A 1cmaA-4fxpA:
undetectable
1cmaB-4fxpA:
undetectable		 1cmaA-4fxpA:
20.94
1cmaB-4fxpA:
20.94
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.
4gtv GERANYLGERANYL
TRANSFERASE TYPE-2
SUBUNIT ALPHA

(Rattus
norvegicus) 		PF01239
(PPTA) 		4 GLU A 128
ARG A 127
HIS A 112
LEU A  96
 None
 1.04A 1cmaA-4gtvA:
undetectable
1cmaB-4gtvA:
undetectable		 1cmaA-4gtvA:
15.20
1cmaB-4gtvA:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4hh8 BUTYROPHILIN
SUBFAMILY 1 MEMBER
A1

(Bos taurus) 		PF07686
(V-set)
PF08205
(C2-set_2) 		5 GLU A  36
ARG A 101
ARG A  52
LEU A  50
GLU A  60
 None
 1.07A 1cmaA-4hh8A:
undetectable
1cmaB-4hh8A:
undetectable		 1cmaA-4hh8A:
17.27
1cmaB-4hh8A:
17.27
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.
4hh8 BUTYROPHILIN
SUBFAMILY 1 MEMBER
A1

(Bos taurus) 		PF07686
(V-set)
PF08205
(C2-set_2) 		5 PHE A  99
GLU A  36
ARG A  52
LEU A  50
GLU A  60
 None
 1.14A 1cmaA-4hh8A:
undetectable
1cmaB-4hh8A:
undetectable		 1cmaA-4hh8A:
17.27
1cmaB-4hh8A:
17.27
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.
4im7 HYPOTHETICAL
OXIDOREDUCTASE YDFI

(Escherichia
coli) 		PF01232
(Mannitol_dh)
PF08125
(Mannitol_dh_C) 		4 GLU A 165
ARG A 169
LEU A 110
GLU A 107
 None
 0.94A 1cmaA-4im7A:
undetectable
1cmaB-4im7A:
undetectable		 1cmaA-4im7A:
11.27
1cmaB-4im7A:
11.27
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.
4j75 TRYPTOPHANYL-TRNA
SYNTHETASE

(Plasmodium
falciparum) 		PF00579
(tRNA-synt_1b) 		4 ARG A 266
LEU A 270
GLU A 298
HIS A 300
 None
 1.02A 1cmaA-4j75A:
undetectable
1cmaB-4j75A:
undetectable		 1cmaA-4j75A:
13.71
1cmaB-4j75A:
13.71
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.
4jwh TRNA
(GUANINE(9)-N1)-METH
YLTRANSFERASE

(Schizosaccharomyces
pombe) 		PF01746
(tRNA_m1G_MT) 		4 GLU A 267
ARG A  84
LEU A 254
GLU A 257
 None
 0.77A 1cmaA-4jwhA:
undetectable
1cmaB-4jwhA:
undetectable		 1cmaA-4jwhA:
18.58
1cmaB-4jwhA:
18.58
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.
4jxc FEFE-HYDROGENASE
MATURASE

(Thermotoga
maritima) 		PF04055
(Radical_SAM)
PF06968
(BATS) 		4 GLU A 146
ARG A 142
LEU A 190
GLU A 189
 None
 0.84A 1cmaA-4jxcA:
undetectable
1cmaB-4jxcA:
undetectable		 1cmaA-4jxcA:
13.18
1cmaB-4jxcA:
13.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4l6r SOLUBLE CYTOCHROME
B562 AND GLUCAGON
RECEPTOR CHIMERA

(Escherichia
coli;
Homo sapiens) 		PF00002
(7tm_2)
PF07361
(Cytochrom_B562) 		4 GLU A 410
ARG A 413
ARG A 414
LEU A 166
 None
 0.72A 1cmaA-4l6rA:
undetectable
1cmaB-4l6rA:
undetectable		 1cmaA-4l6rA:
13.35
1cmaB-4l6rA:
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.
4lmp ALANINE
DEHYDROGENASE

(Mycobacterium
tuberculosis) 		PF01262
(AlaDh_PNT_C)
PF05222
(AlaDh_PNT_N) 		4 GLU A  25
ARG A  28
ARG A  29
LEU A 322
 None
 0.98A 1cmaA-4lmpA:
undetectable
1cmaB-4lmpA:
undetectable		 1cmaA-4lmpA:
13.54
1cmaB-4lmpA:
13.54
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.
4m7r ANAMORSIN

(Homo sapiens) 		PF08241
(Methyltransf_11) 		4 GLU A 106
ARG A 109
LEU A  74
GLU A  69
 None
 1.03A 1cmaA-4m7rA:
undetectable
1cmaB-4m7rA:
undetectable		 1cmaA-4m7rA:
21.84
1cmaB-4m7rA:
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.
4nme PROLINE
DEHYDROGENASE AND
DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE

(Geobacter
sulfurreducens) 		PF00171
(Aldedh)
PF01619
(Pro_dh) 		4 GLU A 346
ARG A 342
LEU A 373
GLU A 372
 None
 0.92A 1cmaA-4nmeA:
undetectable
1cmaB-4nmeA:
undetectable		 1cmaA-4nmeA:
7.96
1cmaB-4nmeA:
7.96
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.
4odm PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD

(Thermus
thermophilus) 		PF00254
(FKBP_C) 		4 ARG A 136
GLU A 142
HIS A  33
LEU A  30
 ACT  A 202 (-4.0A)
None
None
None
 1.05A 1cmaA-4odmA:
undetectable
1cmaB-4odmA:
undetectable		 1cmaA-4odmA:
19.75
1cmaB-4odmA:
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.
4odr PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A CHIMERA

(Thermus
thermophilus;
Homo sapiens) 		PF00254
(FKBP_C) 		4 ARG A  88
GLU A  94
HIS A  33
LEU A  30
 GOL  A 207 (-3.5A)
None
ZN  A 203 (-3.2A)
None
 0.99A 1cmaA-4odrA:
undetectable
1cmaB-4odrA:
undetectable		 1cmaA-4odrA:
22.05
1cmaB-4odrA:
22.05
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.
4p7w L-PROLINE
CIS-4-HYDROXYLASE

(Mesorhizobium
japonicum) 		PF05118
(Asp_Arg_Hydrox)
PF05373
(Pro_3_hydrox_C) 		4 GLU A 247
ARG A 250
ARG A 251
GLU A 206
 None
 0.63A 1cmaA-4p7wA:
undetectable
1cmaB-4p7wA:
undetectable		 1cmaA-4p7wA:
19.52
1cmaB-4p7wA:
19.52
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.
4p7w L-PROLINE
CIS-4-HYDROXYLASE

(Mesorhizobium
japonicum) 		PF05118
(Asp_Arg_Hydrox)
PF05373
(Pro_3_hydrox_C) 		4 GLU A 247
ARG A 250
LEU A 209
GLU A 206
 None
 0.99A 1cmaA-4p7wA:
undetectable
1cmaB-4p7wA:
undetectable		 1cmaA-4p7wA:
19.52
1cmaB-4p7wA:
19.52
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.
4rfv BIFUNCTIONAL ENZYME
CYSN/CYSC

(Mycobacterium
tuberculosis) 		PF01583
(APS_kinase) 		4 GLU A 499
ARG A 502
ARG A 503
LEU A 490
 None
 0.78A 1cmaA-4rfvA:
undetectable
1cmaB-4rfvA:
undetectable		 1cmaA-4rfvA:
21.43
1cmaB-4rfvA:
21.43
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.
4ure CYCLOHEXANOL
DEHYDROGENASE

(Aromatoleum
aromaticum) 		PF13561
(adh_short_C2) 		4 GLU A 205
ARG A 202
ARG A 201
LEU A 213
 None
 0.77A 1cmaA-4ureA:
undetectable
1cmaB-4ureA:
undetectable		 1cmaA-4ureA:
21.26
1cmaB-4ureA:
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.
4wp2 PUTATIVE MRNA EXPORT
PROTEIN

(Chaetomium
thermophilum) 		PF03943
(TAP_C) 		4 GLU A 608
ARG A 611
LEU A 632
GLU A 633
 None
 0.61A 1cmaA-4wp2A:
undetectable
1cmaB-4wp2A:
undetectable		 1cmaA-4wp2A:
21.90
1cmaB-4wp2A:
21.90
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.
4wpg DTDP-4-DEHYDRORHAMNO
SE REDUCTASE

(Streptococcus
pyogenes) 		PF04321
(RmlD_sub_bind) 		4 GLU A 193
ARG A 189
LEU A  18
GLU A  21
 None
 0.82A 1cmaA-4wpgA:
undetectable
1cmaB-4wpgA:
undetectable		 1cmaA-4wpgA:
21.13
1cmaB-4wpgA:
21.13
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.
4x2d FIC FAMILY PROTEIN
PUTATIVE
FILAMENTATION
INDUCED BY CAMP
PROTEIN

(Clostridioides
difficile) 		PF02661
(Fic) 		4 PHE A 165
ARG A 171
LEU A  95
GLU A  64
 None
ATP  A 302 (-4.0A)
None
None
 1.06A 1cmaA-4x2dA:
undetectable
1cmaB-4x2dA:
undetectable		 1cmaA-4x2dA:
15.51
1cmaB-4x2dA:
15.51
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.
4zfz MAJOR
HISTOCOMPATIBILITY
COMPLEX CLASS I

(Macaca mulatta) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 GLU A  62
ARG A  65
ARG A  66
GLU A 163
 None
None
EDO  A 307 (-4.9A)
EDO  A 307 (-3.5A)
 0.67A 1cmaA-4zfzA:
undetectable
1cmaB-4zfzA:
undetectable		 1cmaA-4zfzA:
16.55
1cmaB-4zfzA:
16.55
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.
5ds0 PEPTIDASE M42

(Thaumarchaeota
archaeon SCGC
AB-539-E09) 		PF05343
(Peptidase_M42) 		4 GLU A 190
ARG A 193
ARG A 194
GLU A 337
 None
 0.77A 1cmaA-5ds0A:
undetectable
1cmaB-5ds0A:
undetectable		 1cmaA-5ds0A:
16.06
1cmaB-5ds0A:
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.
5e7q ACYL-COA SYNTHETASE

(Streptomyces
platensis) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 ARG A  38
LEU A 148
GLU A 145
HIS A 134
 None
 0.82A 1cmaA-5e7qA:
undetectable
1cmaB-5e7qA:
undetectable		 1cmaA-5e7qA:
11.76
1cmaB-5e7qA:
11.76
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.
5e8h GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE 3,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00348
(polyprenyl_synt) 		4 GLU A 198
ARG A 223
ARG A 219
GLU A 152
 None
 0.80A 1cmaA-5e8hA:
undetectable
1cmaB-5e8hA:
0.3		 1cmaA-5e8hA:
15.34
1cmaB-5e8hA:
15.34
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.
5e8k GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE 10,
MITOCHONDRIAL

(Arabidopsis
thaliana) 		PF00348
(polyprenyl_synt) 		4 GLU A 196
ARG A 221
ARG A 217
GLU A 151
 None
 0.62A 1cmaA-5e8kA:
undetectable
1cmaB-5e8kA:
1.2		 1cmaA-5e8kA:
15.33
1cmaB-5e8kA:
15.33
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.
5e8l HETERODIMERIC
GERANYLGERANYL
PYROPHOSPHATE
SYNTHASE LARGE
SUBUNIT 1,
CHLOROPLASTIC

(Arabidopsis
thaliana) 		PF00348
(polyprenyl_synt) 		4 GLU A 198
ARG A 223
ARG A 219
GLU A 152
 None
 0.64A 1cmaA-5e8lA:
undetectable
1cmaB-5e8lA:
undetectable		 1cmaA-5e8lA:
16.40
1cmaB-5e8lA:
16.40
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.
5ep8 PYRIMIDINE-NUCLEOSID
E PHOSPHORYLASE

(Bacillus
subtilis) 		PF00591
(Glycos_transf_3)
PF02885
(Glycos_trans_3N)
PF07831
(PYNP_C) 		4 GLU A 297
ARG A 293
LEU A 273
GLU A 270
 GLU  A 297 ( 0.6A)
ARG  A 293 ( 0.6A)
LEU  A 273 ( 0.6A)
GLU  A 270 ( 0.6A)
 1.06A 1cmaA-5ep8A:
undetectable
1cmaB-5ep8A:
undetectable		 1cmaA-5ep8A:
17.07
1cmaB-5ep8A:
17.07
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.
5gaj DE NOVO DESIGNED
PROTEIN OR258

(synthetic
construct) 		no annotation 4 ARG A 107
LEU A 122
GLU A 121
HIS A 131
 None
 0.96A 1cmaA-5gajA:
undetectable
1cmaB-5gajA:
undetectable		 1cmaA-5gajA:
21.32
1cmaB-5gajA:
21.32
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.
5iud DNA POLYMERASE ALPHA
CATALYTIC SUBUNIT

(Homo sapiens) 		PF00136
(DNA_pol_B)
PF03104
(DNA_pol_B_exo1) 		4 GLU A 789
ARG A 966
LEU A 793
GLU A 485
 None
 0.80A 1cmaA-5iudA:
undetectable
1cmaB-5iudA:
undetectable		 1cmaA-5iudA:
8.50
1cmaB-5iudA:
8.50
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.
5m8t 5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE

(Homo sapiens) 		PF00264
(Tyrosinase) 		4 GLU A 413
ARG A 416
ARG A 417
LEU A 337
 None
 0.97A 1cmaA-5m8tA:
undetectable
1cmaB-5m8tA:
undetectable		 1cmaA-5m8tA:
11.42
1cmaB-5m8tA:
11.42
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.
5op0 DNA POLYMERASE LIGD,
POLYMERASE DOMAIN

(Mycolicibacterium
smegmatis) 		no annotation 4 GLU B 206
ARG B 210
LEU B 163
GLU B 166
 None
 0.82A 1cmaA-5op0B:
undetectable
1cmaB-5op0B:
undetectable		 1cmaA-5op0B:
17.30
1cmaB-5op0B:
17.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5t38 EVDMO1

(Micromonospora
carbonacea) 		PF13847
(Methyltransf_31) 		4 GLU A   5
ARG A   8
ARG A   9
GLU A  98
 None
 1.06A 1cmaA-5t38A:
undetectable
1cmaB-5t38A:
undetectable		 1cmaA-5t38A:
18.82
1cmaB-5t38A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vrb TRANSKETOLASE

(Neisseria
gonorrhoeae) 		PF00456
(Transketolase_N)
PF02779
(Transket_pyr)
PF02780
(Transketolase_C) 		4 GLU A 321
ARG A 324
ARG A 325
GLU A 133
 None
 0.96A 1cmaA-5vrbA:
undetectable
1cmaB-5vrbA:
undetectable		 1cmaA-5vrbA:
10.65
1cmaB-5vrbA:
10.65
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.
5x9y DNA MISMATCH REPAIR
PROTEIN MUTL

(Aquifex
aeolicus) 		no annotation 4 GLU C 115
ARG C 127
ARG C 104
GLU C 138
 None
 1.01A 1cmaA-5x9yC:
undetectable
1cmaB-5x9yC:
undetectable		 1cmaA-5x9yC:
16.33
1cmaB-5x9yC:
16.33
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.
6b8v ADENYLYLSULFATE
KINASE

(Cryptococcus
neoformans) 		no annotation 4 GLU A  81
ARG A  84
ARG A  85
LEU A  72
 None
 0.77A 1cmaA-6b8vA:
undetectable
1cmaB-6b8vA:
undetectable		 1cmaA-6b8vA:
21.89
1cmaB-6b8vA:
21.89
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.
6cxd PEPTIDASE B

(Yersinia pestis) 		no annotation 4 GLU A 100
ARG A 104
LEU A  69
GLU A  70
 SO4  A 501 (-4.2A)
SO4  A 501 (-4.5A)
None
SO4  A 501 (-4.1A)
 0.76A 1cmaA-6cxdA:
undetectable
1cmaB-6cxdA:
undetectable		 1cmaA-6cxdA:
undetectable
1cmaB-6cxdA:
undetectable