SIMILAR PATTERNS OF AMINO ACIDS FOR 1CQP_A_803A311

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.
1dmu BGLI RESTRICTION
ENDONUCLEASE

(Bacillus
subtilis) 		PF14562
(Endonuc_BglI) 		5 LEU A 121
VAL A 106
ILE A 104
LEU A  38
VAL A 141
 None
 1.13A 1cqpA-1dmuA:
undetectable
1cqpB-1dmuA:
undetectable		 1cqpA-1dmuA:
20.78
1cqpB-1dmuA:
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.
1ecx AMINOTRANSFERASE

(Thermotoga
maritima) 		PF00266
(Aminotran_5) 		5 LEU A 132
VAL A 136
ILE A 164
GLU A 193
VAL A 174
 None
 1.16A 1cqpA-1ecxA:
2.1
1cqpB-1ecxA:
2.1		 1cqpA-1ecxA:
17.96
1cqpB-1ecxA:
17.96
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.
1ep8 THIOREDOXIN CH1,
H-TYPE

(Chlamydomonas
reinhardtii) 		PF00085
(Thioredoxin) 		5 LEU A  60
VAL A  29
ILE A  27
TYR A  85
VAL A  70
 None
 1.13A 1cqpA-1ep8A:
undetectable
1cqpB-1ep8A:
undetectable		 1cqpA-1ep8A:
21.43
1cqpB-1ep8A:
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.
1g3r CELL DIVISION
INHIBITOR

(Pyrococcus
furiosus) 		PF13614
(AAA_31) 		5 LEU A 116
ILE A   5
LEU A 194
GLU A 232
LEU A 229
 None
 1.05A 1cqpA-1g3rA:
2.5
1cqpB-1g3rA:
undetectable		 1cqpA-1g3rA:
23.63
1cqpB-1g3rA:
23.63
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.
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 VAL A 102
ILE A 144
GLU A  84
LEU A  83
VAL A 237
 None
 1.14A 1cqpA-1j3nA:
undetectable
1cqpB-1j3nA:
undetectable		 1cqpA-1j3nA:
17.17
1cqpB-1j3nA:
17.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n60 CARBON MONOXIDE
DEHYDROGENASE LARGE
CHAIN

(Oligotropha
carboxidovorans) 		PF01315
(Ald_Xan_dh_C)
PF02738
(Ald_Xan_dh_C2) 		5 VAL B 111
ILE B  64
TYR B 140
GLU B 137
VAL B  55
 None
 1.02A 1cqpA-1n60B:
undetectable
1cqpB-1n60B:
undetectable		 1cqpA-1n60B:
14.33
1cqpB-1n60B:
14.33
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.
1ny5 TRANSCRIPTIONAL
REGULATOR (NTRC
FAMILY)

(Aquifex
aeolicus) 		PF00072
(Response_reg)
PF00158
(Sigma54_activat) 		5 LEU A 235
ILE A 275
LEU A 296
LEU A 243
VAL A 196
 None
 0.99A 1cqpA-1ny5A:
5.1
1cqpB-1ny5A:
5.2		 1cqpA-1ny5A:
18.41
1cqpB-1ny5A:
18.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1qzz ACLACINOMYCIN-10-HYD
ROXYLASE

(Streptomyces
purpurascens) 		PF00891
(Methyltransf_2) 		5 LEU A 254
VAL A 257
ILE A 269
LEU A 245
VAL A 212
 None
SAM  A 635 ( 4.7A)
None
None
None
 1.12A 1cqpA-1qzzA:
undetectable
1cqpB-1qzzA:
undetectable		 1cqpA-1qzzA:
20.06
1cqpB-1qzzA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1rfv PYRIDOXAL KINASE

(Ovis aries) 		PF08543
(Phos_pyr_kin) 		5 VAL A  80
ILE A  10
LEU A  91
LYS A 139
VAL A 140
 None
 1.15A 1cqpA-1rfvA:
undetectable
1cqpB-1rfvA:
3.6		 1cqpA-1rfvA:
22.45
1cqpB-1rfvA:
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.
1w6f ARYLAMINE
N-ACETYLTRANSFERASE

(Mycolicibacterium
smegmatis) 		PF00797
(Acetyltransf_2) 		5 LEU A 246
VAL A 245
ILE A 249
LEU A  44
VAL A 272
 None
 1.20A 1cqpA-1w6fA:
undetectable
1cqpB-1w6fA:
undetectable		 1cqpA-1w6fA:
20.58
1cqpB-1w6fA:
20.58
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.
1wlo SUFE PROTEIN

(Thermus
thermophilus) 		PF02657
(SufE) 		5 LEU A   6
VAL A   2
LEU A 116
GLU A 108
LEU A 107
 None
 1.20A 1cqpA-1wloA:
undetectable
1cqpB-1wloA:
undetectable		 1cqpA-1wloA:
20.74
1cqpB-1wloA:
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.
1xe4 FEMX

(Weissella
viridescens) 		PF02388
(FemAB) 		5 LEU A 246
ILE A 244
TYR A 256
LEU A 192
VAL A  35
 None
 1.12A 1cqpA-1xe4A:
undetectable
1cqpB-1xe4A:
undetectable		 1cqpA-1xe4A:
19.69
1cqpB-1xe4A:
19.69
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.
1z7s HUMAN COXSACKIEVIRUS
A21

(Enterovirus C) 		PF00073
(Rhv) 		5 LEU 2 126
VAL 2 210
ILE 2 108
TYR 2 106
LEU 2  66
 None
 1.06A 1cqpA-1z7s2:
undetectable
1cqpB-1z7s2:
undetectable		 1cqpA-1z7s2:
22.22
1cqpB-1z7s2:
22.22
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.
2awa DNA POLYMERASE III,
BETA CHAIN

(Streptococcus
pneumoniae) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 LEU A  77
VAL A  34
ILE A  36
LEU A  94
VAL A  86
 None
 1.17A 1cqpA-2awaA:
undetectable
1cqpB-2awaA:
undetectable		 1cqpA-2awaA:
19.55
1cqpB-2awaA:
19.55
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.
2bex RIBONUCLEASE
INHIBITOR

(Homo sapiens) 		PF13516
(LRR_6) 		5 LEU A 233
ILE A 262
LEU A 285
LEU A 257
VAL A 222
 None
 1.20A 1cqpA-2bexA:
undetectable
1cqpB-2bexA:
undetectable		 1cqpA-2bexA:
15.37
1cqpB-2bexA:
15.37
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.
2czc GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF01113
(DapB_N)
PF02800
(Gp_dh_C) 		5 LEU A 246
VAL A 278
ILE A 283
TYR A 292
LEU A 229
 None
 1.00A 1cqpA-2czcA:
2.8
1cqpB-2czcA:
undetectable		 1cqpA-2czcA:
18.52
1cqpB-2czcA:
18.52
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.
2egz 3-DEHYDROQUINATE
DEHYDRATASE

(Aquifex
aeolicus) 		PF01487
(DHquinase_I) 		5 LEU A  54
VAL A  49
GLU A 196
LEU A 206
VAL A   5
 None
 1.10A 1cqpA-2egzA:
undetectable
1cqpB-2egzA:
undetectable		 1cqpA-2egzA:
24.39
1cqpB-2egzA:
24.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ffm SAV1430

(Staphylococcus
aureus) 		PF08712
(Nfu_N) 		5 LEU A  46
VAL A  51
ILE A  54
LEU A  19
VAL A  81
 None
 1.19A 1cqpA-2ffmA:
undetectable
1cqpB-2ffmA:
undetectable		 1cqpA-2ffmA:
18.82
1cqpB-2ffmA:
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.
2gfg BH2851

(Bacillus
halodurans) 		PF01928
(CYTH) 		5 LEU A 168
ILE A 167
LEU A  25
LEU A  21
VAL A  13
 None
 1.12A 1cqpA-2gfgA:
undetectable
1cqpB-2gfgA:
undetectable		 1cqpA-2gfgA:
21.74
1cqpB-2gfgA:
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.
2gu0 NONSTRUCTURAL
PROTEIN 2

(Rotavirus C) 		PF02509
(Rota_NS35) 		5 VAL A   8
LEU A 115
GLU A 112
LEU A 111
VAL A 106
 None
 0.99A 1cqpA-2gu0A:
undetectable
1cqpB-2gu0A:
undetectable		 1cqpA-2gu0A:
22.78
1cqpB-2gu0A:
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.
2ify 2,3-BISPHOSPHOGLYCER
ATE-INDEPENDENT
PHOSPHOGLYCERATE
MUTASE

(Bacillus
anthracis) 		PF01676
(Metalloenzyme)
PF06415
(iPGM_N) 		5 ILE A 255
LEU A 134
GLU A 138
LYS A 104
VAL A 103
 None
 1.11A 1cqpA-2ifyA:
undetectable
1cqpB-2ifyA:
2.1		 1cqpA-2ifyA:
17.59
1cqpB-2ifyA:
17.59
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.
2j4r EXOPOLYPHOSPHATASE

(Aquifex
aeolicus) 		PF02541
(Ppx-GppA) 		5 LEU A  45
ILE A  60
GLU A 101
LEU A 100
VAL A 111
 None
 1.17A 1cqpA-2j4rA:
undetectable
1cqpB-2j4rA:
undetectable		 1cqpA-2j4rA:
21.54
1cqpB-2j4rA:
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.
2k77 NEGATIVE REGULATOR
OF GENETIC
COMPETENCE CLPC/MECB

(Bacillus
subtilis) 		PF02861
(Clp_N) 		5 LEU A  14
VAL A  13
ILE A  34
GLU A  94
VAL A 103
 None
 0.93A 1cqpA-2k77A:
undetectable
1cqpB-2k77A:
undetectable		 1cqpA-2k77A:
17.30
1cqpB-2k77A:
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.
2lae LIPOPROTEIN 34

(Escherichia
coli) 		PF06804
(Lipoprotein_18) 		5 LEU A 259
TYR A 280
LEU A 326
LEU A 334
VAL A 337
 None
 1.09A 1cqpA-2laeA:
undetectable
1cqpB-2laeA:
undetectable		 1cqpA-2laeA:
22.66
1cqpB-2laeA:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nya PERIPLASMIC NITRATE
REDUCTASE

(Escherichia
coli) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF04879
(Molybdop_Fe4S4) 		5 LEU A 354
VAL A 351
LEU A 316
LEU A 319
VAL A 174
 None
 1.08A 1cqpA-2nyaA:
undetectable
1cqpB-2nyaA:
3.3		 1cqpA-2nyaA:
12.81
1cqpB-2nyaA:
12.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v0j BIFUNCTIONAL PROTEIN
GLMU

(Haemophilus
influenzae) 		PF00132
(Hexapep)
PF12804
(NTP_transf_3) 		5 LEU A 286
VAL A 290
ILE A 292
LEU A 315
VAL A 320
 None
 1.20A 1cqpA-2v0jA:
undetectable
1cqpB-2v0jA:
undetectable		 1cqpA-2v0jA:
16.89
1cqpB-2v0jA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wjv REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 LEU A 232
VAL A 191
GLU A 178
LEU A 170
VAL A 135
 None
 1.15A 1cqpA-2wjvA:
undetectable
1cqpB-2wjvA:
undetectable		 1cqpA-2wjvA:
15.03
1cqpB-2wjvA:
15.03
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.
2wpg AMYLOSUCRASE OR
ALPHA AMYLASE

(Xanthomonas
campestris) 		PF00128
(Alpha-amylase)
PF11941
(DUF3459) 		5 VAL A 121
TYR A  95
LEU A 127
LEU A 126
VAL A 109
 None
 1.16A 1cqpA-2wpgA:
undetectable
1cqpB-2wpgA:
undetectable		 1cqpA-2wpgA:
13.68
1cqpB-2wpgA:
13.68
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.
2x7j 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE
-1-CARBOXYLATE
SYNTHASE

(Bacillus
subtilis) 		PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N)
PF16582
(TPP_enzyme_M_2) 		5 LEU A 386
VAL A 482
ILE A 480
LEU A 400
VAL A 411
 None
 1.18A 1cqpA-2x7jA:
4.1
1cqpB-2x7jA:
3.7		 1cqpA-2x7jA:
15.89
1cqpB-2x7jA:
15.89
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.
2yrl KIAA1837 PROTEIN

(Homo sapiens) 		PF00801
(PKD) 		5 LEU A  17
VAL A  93
TYR A  71
LYS A  44
LEU A  53
 None
 0.61A 1cqpA-2yrlA:
undetectable
1cqpB-2yrlA:
undetectable		 1cqpA-2yrlA:
24.68
1cqpB-2yrlA:
24.68
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.
2z1k (NEO)PULLULANASE

(Thermus
thermophilus) 		PF00128
(Alpha-amylase) 		5 LEU A 102
VAL A  52
ILE A  67
LEU A 115
VAL A  72
 None
 1.13A 1cqpA-2z1kA:
undetectable
1cqpB-2z1kA:
undetectable		 1cqpA-2z1kA:
14.57
1cqpB-2z1kA:
14.57
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.
3a9i HOMOCITRATE SYNTHASE

(Thermus
thermophilus) 		PF00682
(HMGL-like) 		5 LEU A  11
VAL A  44
ILE A  42
LEU A  63
VAL A  59
 None
 1.21A 1cqpA-3a9iA:
undetectable
1cqpB-3a9iA:
undetectable		 1cqpA-3a9iA:
19.25
1cqpB-3a9iA:
19.25
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.
3auo DNA POLYMERASE BETA
FAMILY (X FAMILY)

(Thermus
thermophilus) 		PF14520
(HHH_5)
PF14716
(HHH_8)
PF14791
(DNA_pol_B_thumb) 		5 ILE A 416
GLU A 459
LEU A 458
LYS A 494
VAL A 496
 None
 1.10A 1cqpA-3auoA:
undetectable
1cqpB-3auoA:
undetectable		 1cqpA-3auoA:
14.31
1cqpB-3auoA:
14.31
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.
3bdl STAPHYLOCOCCAL
NUCLEASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00565
(SNase)
PF00567
(TUDOR) 		5 LEU A 586
VAL A 569
ILE A 588
GLU A 562
VAL A 509
 None
 1.20A 1cqpA-3bdlA:
undetectable
1cqpB-3bdlA:
undetectable		 1cqpA-3bdlA:
15.64
1cqpB-3bdlA:
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.
3cwv DNA GYRASE, B
SUBUNIT, TRUNCATED

(Myxococcus
xanthus) 		PF00204
(DNA_gyraseB) 		5 VAL A 124
TYR A 111
LEU A  37
LEU A 101
VAL A  80
 None
 1.21A 1cqpA-3cwvA:
undetectable
1cqpB-3cwvA:
undetectable		 1cqpA-3cwvA:
19.77
1cqpB-3cwvA:
19.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3cze SUCROSE HYDROLASE

(Xanthomonas
citri) 		PF00128
(Alpha-amylase) 		5 VAL A 120
TYR A  94
LEU A 126
LEU A 125
VAL A 108
 None
 1.16A 1cqpA-3czeA:
undetectable
1cqpB-3czeA:
undetectable		 1cqpA-3czeA:
14.96
1cqpB-3czeA:
14.96
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.
3d9w PUTATIVE
ACETYLTRANSFERASE

(Nocardia
farcinica) 		PF00797
(Acetyltransf_2) 		5 LEU A 224
ILE A 269
LEU A 276
LEU A 279
VAL A  57
 None
 1.20A 1cqpA-3d9wA:
undetectable
1cqpB-3d9wA:
undetectable		 1cqpA-3d9wA:
19.03
1cqpB-3d9wA:
19.03
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.
3dew TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY

(Geobacter
sulfurreducens) 		PF00440
(TetR_N) 		5 LEU A 128
VAL A 124
ILE A  70
LEU A  85
VAL A 158
 None
ACY  A 209 ( 4.7A)
None
None
None
 1.16A 1cqpA-3dewA:
undetectable
1cqpB-3dewA:
undetectable		 1cqpA-3dewA:
21.33
1cqpB-3dewA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3euc HISTIDINOL-PHOSPHATE
AMINOTRANSFERASE 2

(Cupriavidus
pinatubonensis) 		PF00155
(Aminotran_1_2) 		5 LEU A  89
VAL A 256
GLU A 269
LEU A 268
VAL A 224
 None
 1.16A 1cqpA-3eucA:
undetectable
1cqpB-3eucA:
undetectable		 1cqpA-3eucA:
15.76
1cqpB-3eucA:
15.76
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.
3gge PDZ
DOMAIN-CONTAINING
PROTEIN GIPC2

(Homo sapiens) 		PF00595
(PDZ) 		5 LEU A 182
VAL A 178
ILE A 165
GLU A 115
LEU A 195
 None
 1.10A 1cqpA-3ggeA:
undetectable
1cqpB-3ggeA:
undetectable		 1cqpA-3ggeA:
22.22
1cqpB-3ggeA:
22.22
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.
3iby FERROUS IRON
TRANSPORT PROTEIN B

(Legionella
pneumophila) 		PF02421
(FeoB_N) 		5 LEU A  17
ILE A 154
LEU A  45
LEU A 161
VAL A 114
 None
 1.02A 1cqpA-3ibyA:
2.4
1cqpB-3ibyA:
3.9		 1cqpA-3ibyA:
24.91
1cqpB-3ibyA:
24.91
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.
3icq EXPORTIN-T

(Schizosaccharomyces
pombe) 		PF08389
(Xpo1) 		5 LEU T 671
VAL T 719
ILE T 715
LEU T 658
LEU T 654
 None
 1.19A 1cqpA-3icqT:
undetectable
1cqpB-3icqT:
undetectable		 1cqpA-3icqT:
10.79
1cqpB-3icqT:
10.79
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.
3icq EXPORTIN-T

(Schizosaccharomyces
pombe) 		PF08389
(Xpo1) 		5 LEU T 758
VAL T 757
ILE T 761
GLU T 831
LEU T 780
 None
 1.19A 1cqpA-3icqT:
undetectable
1cqpB-3icqT:
undetectable		 1cqpA-3icqT:
10.79
1cqpB-3icqT:
10.79
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.
3k96 GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD(P)+]

(Coxiella
burnetii) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		5 LEU A 169
VAL A 176
ILE A 135
LYS A 110
VAL A 144
 None
 1.17A 1cqpA-3k96A:
3.0
1cqpB-3k96A:
3.2		 1cqpA-3k96A:
18.34
1cqpB-3k96A:
18.34
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.
3khf MICROTUBULE-ASSOCIAT
ED
SERINE/THREONINE-PRO
TEIN KINASE 3

(Homo sapiens) 		PF00595
(PDZ) 		5 LEU A1023
VAL A1019
ILE A1006
LEU A 997
VAL A 983
 None
 1.19A 1cqpA-3khfA:
undetectable
1cqpB-3khfA:
undetectable		 1cqpA-3khfA:
20.35
1cqpB-3khfA:
20.35
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.
3lxr IPGB2

(Shigella
flexneri) 		PF03278
(IpaB_EvcA) 		5 LEU F 110
ILE F 108
TYR F 106
GLU F 162
VAL F  74
 None
 1.10A 1cqpA-3lxrF:
undetectable
1cqpB-3lxrF:
undetectable		 1cqpA-3lxrF:
23.47
1cqpB-3lxrF:
23.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3m1c ENVELOPE
GLYCOPROTEIN H
ENVELOPE
GLYCOPROTEIN L

(Human
alphaherpesvirus
2) 		PF02489
(Herpes_glycop_H)
PF05259
(Herpes_UL1)
PF12524
(GlyL_C)
PF17488
(Herpes_glycoH_C) 		5 LEU B  72
VAL A  94
ILE B  70
LEU A 114
LEU B 107
 None
 1.20A 1cqpA-3m1cB:
undetectable
1cqpB-3m1cB:
undetectable		 1cqpA-3m1cB:
16.91
1cqpB-3m1cB:
16.91
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.
3mdp CYCLIC
NUCLEOTIDE-BINDING
DOMAIN (CNMP-BD)
PROTEIN

(Geobacter
metallireducens) 		PF00027
(cNMP_binding) 		5 LEU A 114
ILE A 109
LEU A   7
LEU A  16
VAL A 127
 None
 1.20A 1cqpA-3mdpA:
undetectable
1cqpB-3mdpA:
undetectable		 1cqpA-3mdpA:
20.69
1cqpB-3mdpA:
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.
3n91 UNCHARACTERIZED
PROTEIN

(Bacteroides
ovatus) 		PF08522
(DUF1735) 		5 LEU A 152
VAL A 189
ILE A 150
TYR A 191
LEU A 133
 None
 1.10A 1cqpA-3n91A:
undetectable
1cqpB-3n91A:
undetectable		 1cqpA-3n91A:
22.67
1cqpB-3n91A:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ogz UDP-SUGAR
PYROPHOSPHORYLASE

(Leishmania
major) 		PF01704
(UDPGP) 		5 LEU A 473
VAL A 523
ILE A 525
LEU A 500
VAL A 516
 None
 0.99A 1cqpA-3ogzA:
undetectable
1cqpB-3ogzA:
undetectable		 1cqpA-3ogzA:
14.26
1cqpB-3ogzA:
14.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3pco PHENYLALANYL-TRNA
SYNTHETASE, BETA
CHAIN

(Escherichia
coli) 		PF01588
(tRNA_bind)
PF03147
(FDX-ACB)
PF03483
(B3_4)
PF03484
(B5) 		5 LEU B 724
VAL B 738
ILE B 758
GLU B 783
LEU B 785
 None
 1.11A 1cqpA-3pcoB:
undetectable
1cqpB-3pcoB:
undetectable		 1cqpA-3pcoB:
13.01
1cqpB-3pcoB:
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.
3pxg NEGATIVE REGULATOR
OF GENETIC
COMPETENCE CLPC/MECB

(Bacillus
subtilis) 		PF00004
(AAA)
PF02151
(UVR)
PF02861
(Clp_N) 		5 LEU A  14
VAL A  13
ILE A  34
GLU A  94
VAL A 103
 None
 0.88A 1cqpA-3pxgA:
undetectable
1cqpB-3pxgA:
undetectable		 1cqpA-3pxgA:
18.68
1cqpB-3pxgA:
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.
3pxi NEGATIVE REGULATOR
OF GENETIC
COMPETENCE CLPC/MECB

(Bacillus
subtilis) 		PF00004
(AAA)
PF02151
(UVR)
PF02861
(Clp_N)
PF07724
(AAA_2)
PF10431
(ClpB_D2-small) 		5 LEU A  14
VAL A  13
ILE A  34
GLU A  94
VAL A 103
 None
 0.88A 1cqpA-3pxiA:
undetectable
1cqpB-3pxiA:
undetectable		 1cqpA-3pxiA:
12.71
1cqpB-3pxiA:
12.71
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.
3q1y LIN2199 PROTEIN

(Listeria
innocua) 		PF00294
(PfkB) 		5 LEU A 164
ILE A 137
LEU A 121
LYS A 128
VAL A 129
 None
 0.92A 1cqpA-3q1yA:
undetectable
1cqpB-3q1yA:
undetectable		 1cqpA-3q1yA:
22.09
1cqpB-3q1yA:
22.09
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.
3se7 VANA

(-) 		PF01820
(Dala_Dala_lig_N)
PF07478
(Dala_Dala_lig_C) 		5 VAL A  24
ILE A   5
LEU A  88
LEU A  90
VAL A 334
 None
 1.21A 1cqpA-3se7A:
4.2
1cqpB-3se7A:
4.2		 1cqpA-3se7A:
21.66
1cqpB-3se7A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tx8 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Corynebacterium
glutamicum) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 LEU A 276
VAL A 183
ILE A 181
LEU A 231
VAL A 212
 None
 1.12A 1cqpA-3tx8A:
3.2
1cqpB-3tx8A:
2.2		 1cqpA-3tx8A:
19.95
1cqpB-3tx8A:
19.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3v11 TRANSLATION
INITIATION FACTOR 2
SUBUNIT ALPHA

(Sulfolobus
solfataricus) 		PF00575
(S1)
PF07541
(EIF_2_alpha) 		5 VAL B 110
ILE B 106
GLU B 130
LEU B 129
VAL B 156
 None
 1.04A 1cqpA-3v11B:
undetectable
1cqpB-3v11B:
undetectable		 1cqpA-3v11B:
25.30
1cqpB-3v11B:
25.30
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.
3vjj P9-1

(Rice black
streaked dwarf
virus) 		PF06043
(Reo_P9) 		5 LEU A 248
ILE A 241
TYR A 280
LEU A 228
LEU A 225
 None
 1.01A 1cqpA-3vjjA:
undetectable
1cqpB-3vjjA:
undetectable		 1cqpA-3vjjA:
21.85
1cqpB-3vjjA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4age SMALL-CONDUCTANCE
MECHANOSENSITIVE
CHANNEL

(Escherichia
coli) 		PF00924
(MS_channel)
PF05552
(TM_helix) 		5 LEU A 138
VAL A 136
ILE A 175
LEU A 124
VAL A 148
 None
 0.97A 1cqpA-4ageA:
undetectable
1cqpB-4ageA:
undetectable		 1cqpA-4ageA:
20.96
1cqpB-4ageA:
20.96
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.
4ak9 CPFTSY

(Physcomitrella
patens) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 LEU A 306
VAL A 307
LEU A 282
GLU A 285
LEU A 286
 None
 0.95A 1cqpA-4ak9A:
2.8
1cqpB-4ak9A:
2.4		 1cqpA-4ak9A:
21.38
1cqpB-4ak9A:
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.
4ays AMYLOSUCRASE

(Deinococcus
radiodurans) 		PF00128
(Alpha-amylase) 		5 VAL A 116
TYR A  90
LEU A 122
LEU A 121
VAL A 104
 None
 1.21A 1cqpA-4aysA:
undetectable
1cqpB-4aysA:
undetectable		 1cqpA-4aysA:
12.69
1cqpB-4aysA:
12.69
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.
4c7g BETA-N-ACETYLHEXOSAM
INIDASE

(Streptomyces
coelicolor) 		PF00728
(Glyco_hydro_20)
PF02838
(Glyco_hydro_20b) 		5 LEU A 112
VAL A 128
ILE A  25
LEU A  46
VAL A 105
 None
 0.85A 1cqpA-4c7gA:
2.6
1cqpB-4c7gA:
2.7		 1cqpA-4c7gA:
17.68
1cqpB-4c7gA:
17.68
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.
4cs5 PROLIFERATING CELL
NUCLEAR ANTIGEN

(Litopenaeus
vannamei) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 LEU A 235
ILE A 160
GLU A 143
LEU A 139
VAL A 225
 None
 1.18A 1cqpA-4cs5A:
undetectable
1cqpB-4cs5A:
undetectable		 1cqpA-4cs5A:
22.47
1cqpB-4cs5A:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cvh ISOPRENOID SYNTHASE
DOMAIN-CONTAINING
PROTEIN

(Homo sapiens) 		PF01128
(IspD) 		5 LEU A  51
ILE A  93
GLU A 164
LEU A 167
VAL A 162
 None
 0.93A 1cqpA-4cvhA:
4.3
1cqpB-4cvhA:
4.2		 1cqpA-4cvhA:
18.25
1cqpB-4cvhA:
18.25
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.
4e4j ARGININE DEIMINASE

(Mycoplasma
penetrans) 		PF02274
(Amidinotransf) 		5 VAL A 270
ILE A 303
LYS A 353
GLU A 359
LEU A 357
 None
 1.13A 1cqpA-4e4jA:
undetectable
1cqpB-4e4jA:
undetectable		 1cqpA-4e4jA:
17.91
1cqpB-4e4jA:
17.91
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.
4gdj NEURAMINIDASE

(Influenza A
virus) 		PF00064
(Neur) 		5 LEU A 257
VAL A 262
ILE A 205
LEU A 225
VAL A 241
 None
 0.98A 1cqpA-4gdjA:
undetectable
1cqpB-4gdjA:
undetectable		 1cqpA-4gdjA:
19.94
1cqpB-4gdjA:
19.94
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.
4hi0 UREASE ACCESSORY
PROTEIN UREH

(Helicobacter
pylori) 		PF01774
(UreD) 		5 LEU B  35
ILE B  48
LEU B 107
LEU B  67
VAL B  65
 None
 1.18A 1cqpA-4hi0B:
undetectable
1cqpB-4hi0B:
undetectable		 1cqpA-4hi0B:
21.69
1cqpB-4hi0B:
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.
4i6j F-BOX/LRR-REPEAT
PROTEIN 3

(Homo sapiens) 		PF12937
(F-box-like) 		5 LEU B 144
ILE B 179
LEU B 200
LEU B 174
VAL B 167
 None
 1.20A 1cqpA-4i6jB:
undetectable
1cqpB-4i6jB:
undetectable		 1cqpA-4i6jB:
19.69
1cqpB-4i6jB:
19.69
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.
4j6o METALLOPHOSPHOESTERA
SE

(Ruminiclostridium
thermocellum) 		PF00149
(Metallophos) 		5 LEU A 272
ILE A 298
GLU A 243
LEU A 245
VAL A 235
 None
 1.20A 1cqpA-4j6oA:
undetectable
1cqpB-4j6oA:
undetectable		 1cqpA-4j6oA:
20.82
1cqpB-4j6oA:
20.82
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.
4joc LYSOPHOSPHATIDIC
ACID PHOSPHATASE
TYPE 6

(Homo sapiens) 		PF00328
(His_Phos_2) 		5 LEU A 376
ILE A 347
TYR A 378
LEU A 341
VAL A  56
 None
 1.17A 1cqpA-4jocA:
undetectable
1cqpB-4jocA:
undetectable		 1cqpA-4jocA:
18.37
1cqpB-4jocA:
18.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k17 LEUCINE-RICH
REPEAT-CONTAINING
PROTEIN 16A

(Mus musculus) 		PF13516
(LRR_6) 		5 LEU A 394
ILE A 367
LEU A 344
LEU A 372
VAL A 382
 None
 1.15A 1cqpA-4k17A:
undetectable
1cqpB-4k17A:
undetectable		 1cqpA-4k17A:
15.02
1cqpB-4k17A:
15.02
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.
4m7e PROTEIN
BRASSINOSTEROID
INSENSITIVE 1

(Arabidopsis
thaliana) 		PF00560
(LRR_1)
PF08263
(LRRNT_2)
PF12799
(LRR_4)
PF13516
(LRR_6)
PF13855
(LRR_8) 		5 LEU A  84
VAL A  86
ILE A 111
LEU A 127
LEU A 104
 None
 1.12A 1cqpA-4m7eA:
undetectable
1cqpB-4m7eA:
undetectable		 1cqpA-4m7eA:
12.87
1cqpB-4m7eA:
12.87
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.
4mad BETA-GALACTOSIDASE

(Bacillus
circulans) 		PF01301
(Glyco_hydro_35) 		5 LEU A 471
VAL A 464
GLU A 430
LEU A 431
VAL A 410
 None
 0.90A 1cqpA-4madA:
undetectable
1cqpB-4madA:
undetectable		 1cqpA-4madA:
14.83
1cqpB-4madA:
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.
4mps BETA-GALACTOSIDE
ALPHA-2,6-SIALYLTRAN
SFERASE 1

(Rattus
norvegicus) 		PF00777
(Glyco_transf_29) 		5 LEU A 395
VAL A 335
ILE A 325
LEU A 301
LEU A 141
 None
 1.21A 1cqpA-4mpsA:
undetectable
1cqpB-4mpsA:
undetectable		 1cqpA-4mpsA:
18.27
1cqpB-4mpsA:
18.27
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.
4o65 PUTATIVE ARCHAEAL
AMMONIA
MONOOXYGENASE
SUBUNIT B

(Candidatus
Nitrosocaldus
yellowstonensis) 		PF04744
(Monooxygenase_B) 		5 LEU A  54
VAL A 178
ILE A 176
TYR A 155
LEU A 110
 None
 1.18A 1cqpA-4o65A:
undetectable
1cqpB-4o65A:
undetectable		 1cqpA-4o65A:
23.38
1cqpB-4o65A:
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.
4ol0 TRANSPORTIN-3

(Homo sapiens) 		PF08389
(Xpo1) 		5 LEU B 353
ILE B 369
LEU B 328
GLU B 325
LEU B 324
 None
 1.02A 1cqpA-4ol0B:
undetectable
1cqpB-4ol0B:
undetectable		 1cqpA-4ol0B:
11.89
1cqpB-4ol0B:
11.89
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.
4pug BOLA LIKE PROTEIN

(Arabidopsis
thaliana) 		PF01722
(BolA) 		5 LEU A  85
ILE A  87
LEU A 143
LEU A 135
VAL A 131
 None
 1.11A 1cqpA-4pugA:
undetectable
1cqpB-4pugA:
undetectable		 1cqpA-4pugA:
17.54
1cqpB-4pugA:
17.54
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.
4rxl MOLYBDENUM ABC
TRANSPORTER,
PERIPLASMIC
MOLYBDENUM-BINDING
PROTEIN

(Vibrio cholerae) 		PF13531
(SBP_bac_11) 		6 LEU A 108
ILE A 189
LEU A 167
GLU A 164
LEU A 163
VAL A 159
 None
 1.24A 1cqpA-4rxlA:
undetectable
1cqpB-4rxlA:
undetectable		 1cqpA-4rxlA:
18.33
1cqpB-4rxlA:
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.
4w5k ASPARTATE
AMINOTRANSFERASE,
MITOCHONDRIAL

(Trypanosoma
brucei) 		PF00155
(Aminotran_1_2) 		5 LEU A 316
VAL A 317
ILE A 332
LYS A 145
LEU A 344
 None
None
None
EDO  A 502 (-3.0A)
None
 1.18A 1cqpA-4w5kA:
undetectable
1cqpB-4w5kA:
2.2		 1cqpA-4w5kA:
18.98
1cqpB-4w5kA:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4w8j PESTICIDAL CRYSTAL
PROTEIN CRY1AC

(Bacillus
thuringiensis) 		PF00555
(Endotoxin_M)
PF03944
(Endotoxin_C)
PF03945
(Endotoxin_N) 		5 LEU A 762
VAL A 776
ILE A 756
GLU A 865
LEU A 864
 None
 0.90A 1cqpA-4w8jA:
undetectable
1cqpB-4w8jA:
undetectable		 1cqpA-4w8jA:
9.15
1cqpB-4w8jA:
9.15
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.
4wuj GLYCOSIDE HYDROLASE
FAMILY 15, CELLULOSE
SIGNALING ASSOCIATED
PROTEIN ENVOY

(Trichoderma
reesei) 		PF13426
(PAS_9) 		5 LEU A  91
ILE A  81
LEU A 102
LEU A 100
VAL A  98
 None
 1.18A 1cqpA-4wujA:
undetectable
1cqpB-4wujA:
undetectable		 1cqpA-4wujA:
21.74
1cqpB-4wujA:
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.
4yc6 CYCLIN-DEPENDENT
KINASE 1

(Homo sapiens) 		PF00069
(Pkinase) 		5 LEU A  78
VAL A  69
ILE A  52
GLU A  40
LEU A  37
 None
 1.19A 1cqpA-4yc6A:
undetectable
1cqpB-4yc6A:
undetectable		 1cqpA-4yc6A:
24.56
1cqpB-4yc6A:
24.56
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.
4yly PEPTIDYL-TRNA
HYDROLASE

(Staphylococcus
aureus) 		PF01195
(Pept_tRNA_hydro) 		5 LEU A  89
VAL A  25
ILE A 169
GLU A 184
VAL A 100
 None
 1.03A 1cqpA-4ylyA:
2.6
1cqpB-4ylyA:
2.4		 1cqpA-4ylyA:
18.66
1cqpB-4ylyA:
18.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4yly PEPTIDYL-TRNA
HYDROLASE

(Staphylococcus
aureus) 		PF01195
(Pept_tRNA_hydro) 		5 LEU A  89
VAL A  25
ILE A 169
LEU A 102
VAL A 100
 None
 1.15A 1cqpA-4ylyA:
2.6
1cqpB-4ylyA:
2.4		 1cqpA-4ylyA:
18.66
1cqpB-4ylyA:
18.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		5 VAL A  29
ILE A  84
TYR A  27
LEU A 205
LEU A 201
 None
 0.80A 1cqpA-4zhjA:
4.2
1cqpB-4zhjA:
3.1		 1cqpA-4zhjA:
9.19
1cqpB-4zhjA:
9.19
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.
5ax7 PYRUVYL TRANSFERASE
1

(Schizosaccharomyces
pombe) 		PF04230
(PS_pyruv_trans) 		5 LEU A 267
ILE A 263
TYR A 292
LEU A 392
LEU A 389
 None
 0.97A 1cqpA-5ax7A:
2.9
1cqpB-5ax7A:
undetectable		 1cqpA-5ax7A:
18.80
1cqpB-5ax7A:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5cfk PROLIFERATING CELL
NUCLEAR
ANTIGEN,PROLIFERATIN
G CELL NUCLEAR
ANTIGEN

(Leishmania
donovani) 		PF00705
(PCNA_N)
PF02747
(PCNA_C) 		5 LEU A  75
VAL A  78
GLU A   3
LEU A  90
VAL A  99
 None
 1.21A 1cqpA-5cfkA:
undetectable
1cqpB-5cfkA:
undetectable		 1cqpA-5cfkA:
20.99
1cqpB-5cfkA:
20.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5e6s INTEGRIN ALPHA-L

(Homo sapiens) 		PF00092
(VWA)
PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		6 LEU A 132
VAL A 233
ILE A 235
TYR A 257
LYS A 287
LEU A 298
 None
 0.40A 1cqpA-5e6sA:
33.1
1cqpB-5e6sA:
32.9		 1cqpA-5e6sA:
100.00
1cqpB-5e6sA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5edl PUTATIVE
HMP/THIAMINE
PERMEASE PROTEIN
YKOE

(Bacillus
subtilis) 		PF09819
(ABC_cobalt) 		5 LYS A 165
LEU A 182
GLU A 185
LEU A 186
LYS A 189
 None
 0.99A 1cqpA-5edlA:
undetectable
1cqpB-5edlA:
undetectable		 1cqpA-5edlA:
22.07
1cqpB-5edlA:
22.07
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.
5h64 SERINE/THREONINE-PRO
TEIN KINASE MTOR

(Homo sapiens) 		PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08771
(FRB_dom)
PF11865
(DUF3385) 		5 LEU A2508
VAL A2504
ILE A2333
LEU A2201
VAL A2417
 None
 1.20A 1cqpA-5h64A:
undetectable
1cqpB-5h64A:
undetectable		 1cqpA-5h64A:
5.88
1cqpB-5h64A:
5.88
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.
5l3s SIGNAL RECOGNITION
PARTICLE RECEPTOR
FTSY

(Sulfolobus
acidocaldarius) 		PF00448
(SRP54)
PF02881
(SRP54_N) 		5 LEU B 106
VAL B 111
ILE B 119
GLU B 152
VAL B 363
 None
 1.07A 1cqpA-5l3sB:
undetectable
1cqpB-5l3sB:
2.0		 1cqpA-5l3sB:
23.00
1cqpB-5l3sB:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nfn JMJC
DOMAIN-CONTAINING
PROTEIN 7

(Homo sapiens) 		no annotation 5 LEU A 168
VAL A 128
LEU A 146
LEU A 142
VAL A  76
 None
 1.19A 1cqpA-5nfnA:
undetectable
1cqpB-5nfnA:
undetectable		 1cqpA-5nfnA:
15.17
1cqpB-5nfnA:
15.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5oe7 UBIQUITIN
THIOESTERASE OTULIN

(Homo sapiens) 		PF16218
(Peptidase_C101) 		5 LEU A 332
VAL A 304
ILE A 302
TYR A 319
GLU A 290
 None
 1.13A 1cqpA-5oe7A:
undetectable
1cqpB-5oe7A:
undetectable		 1cqpA-5oe7A:
20.00
1cqpB-5oe7A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uyr BACTERIOPHYTOCHROME

(Xanthomonas
campestris) 		no annotation 5 LEU A 439
VAL A 429
GLU A 328
LEU A 330
VAL A 355
 None
 0.89A 1cqpA-5uyrA:
undetectable
1cqpB-5uyrA:
undetectable		 1cqpA-5uyrA:
17.09
1cqpB-5uyrA:
17.09
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.
5x4j UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		no annotation 5 LEU A 104
VAL A 121
LEU A 147
LYS A  18
VAL A  17
 None
 1.12A 1cqpA-5x4jA:
5.0
1cqpB-5x4jA:
5.2		 1cqpA-5x4jA:
21.18
1cqpB-5x4jA:
21.18
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.
5xjg VACUOLAR PROTEIN 8

(Saccharomyces
cerevisiae) 		PF00514
(Arm) 		5 LEU A 491
VAL A 499
GLU A 415
LEU A 414
VAL A 448
 None
 1.11A 1cqpA-5xjgA:
undetectable
1cqpB-5xjgA:
undetectable		 1cqpA-5xjgA:
17.33
1cqpB-5xjgA:
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.
6bja ACETYL-COA
ACETYLTRANSFERASE A

(Ascaris suum) 		no annotation 5 LEU A 303
VAL A 300
LEU A 369
GLU A 373
LEU A 374
 None
 1.13A 1cqpA-6bjaA:
undetectable
1cqpB-6bjaA:
undetectable		 1cqpA-6bjaA:
23.72
1cqpB-6bjaA:
23.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ckb -

(-) 		no annotation 7 LEU A 114
VAL A 215
ILE A 217
TYR A 239
LYS A 269
LEU A 280
GLU A 283
 None
 0.68A 1cqpA-6ckbA:
32.3
1cqpB-6ckbA:
32.2		 1cqpA-6ckbA:
undetectable
1cqpB-6ckbA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f9n CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
SUBUNIT 1

(Homo sapiens) 		no annotation 5 LEU A 963
ILE A 899
GLU A 848
LEU A 864
VAL A 943
 None
 1.03A 1cqpA-6f9nA:
undetectable
1cqpB-6f9nA:
undetectable		 1cqpA-6f9nA:
19.23
1cqpB-6f9nA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6f9n CLEAVAGE AND
POLYADENYLATION
SPECIFICITY FACTOR
SUBUNIT 1

(Homo sapiens) 		no annotation 5 LEU A1182
ILE A1141
TYR A1164
GLU A1098
VAL A1172
 None
 1.13A 1cqpA-6f9nA:
undetectable
1cqpB-6f9nA:
undetectable		 1cqpA-6f9nA:
19.23
1cqpB-6f9nA:
19.23