SIMILAR PATTERNS OF AMINO ACIDS FOR 3BC9_A_ACRA901_1

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.
1a5l UREASE (ALPHA
SUBUNIT)


(Klebsiella
aerogenes)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
4 ASP C 132
SER C 297
GLU C 345
ASP C 346
None
0.99A 3bc9A-1a5lC:
5.2
3bc9A-1a5lC:
21.64
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.
1axt IMMUNOGLOBULIN IGG2A

(Mus musculus)
PF07654
(C1-set)
PF07686
(V-set)
4 ASP H  53
SER H  52
SER H  30
TRP H  33
None
1.20A 3bc9A-1axtH:
5.3
3bc9A-1axtH:
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.
1crz TOLB PROTEIN

(Escherichia
coli)
PF04052
(TolB_N)
PF07676
(PD40)
4 ASP A 317
SER A 360
SER A 406
ASP A 189
None
1.31A 3bc9A-1crzA:
undetectable
3bc9A-1crzA:
22.95
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.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN 2


(Saccharomyces
cerevisiae)
PF00675
(Peptidase_M16)
4 ASP B 358
SER B 294
GLU B 367
ASP B 366
None
1.03A 3bc9A-1ezvB:
undetectable
3bc9A-1ezvB:
21.30
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.
1fyh INTERFERON GAMMA
INTERFERON GAMMA
RECEPTOR 1


(Homo sapiens)
PF00714
(IFN-gamma)
PF01108
(Tissue_fac)
PF07140
(IFNGR1)
4 ASP A  24
SER B  54
LYS B  47
GLU B  45
None
1.09A 3bc9A-1fyhA:
undetectable
3bc9A-1fyhA:
17.48
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.
1hn0 CHONDROITIN ABC
LYASE I


(Proteus
vulgaris)
PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt)
4 SER A 201
SER A  83
LYS A 198
ASP A  56
None
1.23A 3bc9A-1hn0A:
undetectable
3bc9A-1hn0A:
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.
1npc NEUTRAL PROTEASE

(Bacillus cereus)
PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
4 SER A 235
SER A 205
GLU A 188
ASP A 186
None
None
None
CA  A 320 ( 2.9A)
1.34A 3bc9A-1npcA:
undetectable
3bc9A-1npcA:
21.07
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.
1pmi PHOSPHOMANNOSE
ISOMERASE


(Candida
albicans)
PF01238
(PMI_typeI)
4 ASP A 291
SER A  23
GLU A  42
ASP A  41
None
1.23A 3bc9A-1pmiA:
undetectable
3bc9A-1pmiA:
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.
1q6y HYPOTHETICAL PROTEIN
YFDW


(Escherichia
coli)
PF02515
(CoA_transf_3)
4 ASP A  34
SER A  71
GLU A  39
ASP A  45
None
1.29A 3bc9A-1q6yA:
undetectable
3bc9A-1q6yA:
20.51
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.
1r3f TRNA PSEUDOURIDINE
SYNTHASE B


(Escherichia
coli)
PF01509
(TruB_N)
PF09157
(TruB-C_2)
PF16198
(TruB_C_2)
4 ASP A 250
SER A  72
SER A 175
ASP A 118
None
1.25A 3bc9A-1r3fA:
undetectable
3bc9A-1r3fA:
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.
1u0t INORGANIC
POLYPHOSPHATE/ATP-NA
D KINASE


(Mycobacterium
tuberculosis)
PF01513
(NAD_kinase)
4 SER A 194
SER A 162
GLU A 164
ASP A 189
None
1.32A 3bc9A-1u0tA:
undetectable
3bc9A-1u0tA:
20.20
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.
1uky URIDYLATE KINASE

(Saccharomyces
cerevisiae)
PF00406
(ADK)
4 ASP A 191
SER A 188
GLU A 137
ASP A 133
None
1.34A 3bc9A-1ukyA:
undetectable
3bc9A-1ukyA:
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.
1w18 LEVANSUCRASE

(Gluconacetobacter
diazotrophicus)
PF02435
(Glyco_hydro_68)
4 ASP A 135
SER A 485
SER A 418
ASP A 398
None
1.27A 3bc9A-1w18A:
undetectable
3bc9A-1w18A:
22.03
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.
1wkr POLYPOROPEPSIN

(Irpex lacteus)
PF00026
(Asp)
4 ASP A 130
SER A  88
GLU A  72
ASP A  57
None
1.30A 3bc9A-1wkrA:
undetectable
3bc9A-1wkrA:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wmr ISOPULLULANASE

(Aspergillus
niger)
PF03718
(Glyco_hydro_49)
PF17433
(Glyco_hydro_49N)
4 SER A 289
LYS A 287
GLU A 283
ASP A 282
None
1.26A 3bc9A-1wmrA:
4.3
3bc9A-1wmrA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y9g EXO-INULINASE

(Aspergillus
awamori)
PF00251
(Glyco_hydro_32N)
PF08244
(Glyco_hydro_32C)
4 ASP A 509
SER A 507
SER A 453
ASP A 449
NAG  A3001 ( 4.2A)
None
None
None
1.02A 3bc9A-1y9gA:
undetectable
3bc9A-1y9gA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2a4c CADHERIN-11

(Mus musculus)
PF00028
(Cadherin)
4 ASP A  32
SER A  30
SER A  26
GLU A  87
None
1.33A 3bc9A-2a4cA:
4.6
3bc9A-2a4cA:
11.13
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.
2a4e CADHERIN-11

(Mus musculus)
PF00028
(Cadherin)
4 ASP A  32
SER A  30
SER A  26
GLU A  87
None
1.19A 3bc9A-2a4eA:
3.6
3bc9A-2a4eA:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2fv8 RHO-RELATED
GTP-BINDING PROTEIN
RHOB


(Homo sapiens)
PF00071
(Ras)
4 ASP A  87
SER A  85
GLU A  64
ASP A  65
None
None
GDP  A 201 ( 4.8A)
None
1.09A 3bc9A-2fv8A:
undetectable
3bc9A-2fv8A:
15.09
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.
2hb6 LEUCINE
AMINOPEPTIDASE 1


(Caenorhabditis
elegans)
PF00883
(Peptidase_M17)
4 SER A 295
SER A 485
GLU A 158
ASP A 159
None
1.15A 3bc9A-2hb6A:
undetectable
3bc9A-2hb6A:
22.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2i3d HYPOTHETICAL PROTEIN
ATU1826


(Agrobacterium
fabrum)
PF02129
(Peptidase_S15)
4 ASP A  98
SER A  24
SER A 101
GLU A 125
None
1.23A 3bc9A-2i3dA:
undetectable
3bc9A-2i3dA:
18.40
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.
2iop CHAPERONE PROTEIN
HTPG


(Escherichia
coli)
PF00183
(HSP90)
PF02518
(HATPase_c)
4 ASP A 462
SER A 461
SER A 404
ASP A 418
None
1.12A 3bc9A-2iopA:
undetectable
3bc9A-2iopA:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2iu5 HTH-TYPE DHAKLM
OPERON
TRANSCRIPTIONAL
ACTIVATOR DHAS


(Lactococcus
lactis)
PF00440
(TetR_N)
4 ASP A  71
SER A  70
GLU A  64
ASP A  61
None
1.26A 3bc9A-2iu5A:
undetectable
3bc9A-2iu5A:
15.91
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.
2iye COPPER-TRANSPORTING
ATPASE


(Sulfolobus
solfataricus)
PF00702
(Hydrolase)
4 ASP A 416
SER A 562
GLU A 545
ASP A 546
SO4  A1636 (-4.0A)
None
None
None
1.34A 3bc9A-2iyeA:
undetectable
3bc9A-2iyeA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jf4 PERIPLASMIC
TREHALASE


(Escherichia
coli)
PF01204
(Trehalase)
4 ASP A 271
SER A 204
SER A 200
ASP A  65
None
1.17A 3bc9A-2jf4A:
undetectable
3bc9A-2jf4A:
21.46
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.
2jh9 VP4 CORE PROTEIN

(Bluetongue
virus)
PF05059
(Orbi_VP4)
4 ASP A 589
SER A 593
TRP A 578
ASP A 567
None
1.31A 3bc9A-2jh9A:
undetectable
3bc9A-2jh9A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2jqq CONSERVED OLIGOMERIC
GOLGI COMPLEX
SUBUNIT 2


(Saccharomyces
cerevisiae)
no annotation 4 ASP A 138
SER A 170
GLU A 229
ASP A 225
None
1.12A 3bc9A-2jqqA:
undetectable
3bc9A-2jqqA:
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.
2pgg RNA-DIRECTED RNA
POLYMERASE


(Infectious
bursal disease
virus)
PF04197
(Birna_RdRp)
4 SER A 574
TRP A 573
GLU A 531
ASP A 416
None
1.28A 3bc9A-2pggA:
undetectable
3bc9A-2pggA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pvz PRPF METHYLACONITATE
ISOMERASE


(Shewanella
oneidensis)
PF04303
(PrpF)
4 ASP A  97
SER A  95
SER A 275
ASP A 271
None
1.23A 3bc9A-2pvzA:
undetectable
3bc9A-2pvzA:
20.03
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.
2qy1 PECTATE LYASE II

(Xanthomonas
campestris)
PF00544
(Pec_lyase_C)
4 ASP A 209
SER A 206
GLU A 134
ASP A 135
None
1.22A 3bc9A-2qy1A:
undetectable
3bc9A-2qy1A:
20.53
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.
2rhp THROMBOSPONDIN-2

(Homo sapiens)
PF02412
(TSP_3)
PF05735
(TSP_C)
PF07645
(EGF_CA)
PF12947
(EGF_3)
4 ASP A1023
SER A1156
GLU A1051
ASP A1052
CA  A  15 ( 2.5A)
CA  A  13 (-2.3A)
None
None
1.02A 3bc9A-2rhpA:
undetectable
3bc9A-2rhpA:
21.96
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.
2v6b L-LACTATE
DEHYDROGENASE


(Deinococcus
radiodurans)
PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C)
4 ASP A 229
SER A 198
GLU A 194
ASP A 143
None
1.33A 3bc9A-2v6bA:
undetectable
3bc9A-2v6bA:
17.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vmf BETA-MANNOSIDASE

(Bacteroides
thetaiotaomicron)
PF00703
(Glyco_hydro_2)
4 ASP A 407
SER A 325
GLU A 323
ASP A  29
EDO  A1878 (-4.5A)
None
None
None
1.24A 3bc9A-2vmfA:
8.7
3bc9A-2vmfA:
21.55
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.
2wf7 BETA-PHOSPHOGLUCOMUT
ASE


(Lactococcus
lactis)
PF13419
(HAD_2)
4 ASP A   8
SER A 114
SER A  48
LYS A 145
ALF  A1219 ( 2.5A)
ALF  A1219 (-2.8A)
None
ALF  A1219 (-2.7A)
1.14A 3bc9A-2wf7A:
undetectable
3bc9A-2wf7A:
17.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2y4f PEROXIDASE YCDB

(Escherichia
coli)
PF04261
(Dyp_perox)
4 ASP A  13
SER A  11
SER A 186
GLU A 190
None
1.33A 3bc9A-2y4fA:
undetectable
3bc9A-2y4fA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zci PHOSPHOENOLPYRUVATE
CARBOXYKINASE [GTP]


(Corynebacterium
glutamicum)
PF00821
(PEPCK_C)
PF17297
(PEPCK_N)
4 ASP A  79
SER A 219
SER A 183
TRP A 197
None
1.30A 3bc9A-2zciA:
undetectable
3bc9A-2zciA:
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.
3ak5 HEMOGLOBIN-BINDING
PROTEASE HBP


(Escherichia
coli)
PF02395
(Peptidase_S6)
4 ASP A 861
SER A 847
GLU A 851
ASP A 850
None
1.23A 3bc9A-3ak5A:
undetectable
3bc9A-3ak5A:
20.20
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.
3axi OLIGO-1,6-GLUCOSIDAS
E IMA1


(Saccharomyces
cerevisiae)
PF00128
(Alpha-amylase)
4 ASP A 362
SER A 371
SER A 356
GLU A 349
None
1.29A 3bc9A-3axiA:
19.3
3bc9A-3axiA:
20.85
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.
3d31 SULFATE/MOLYBDATE
ABC TRANSPORTER,
ATP-BINDING PROTEIN


(Methanosarcina
acetivorans)
PF00005
(ABC_tran)
PF03459
(TOBE)
4 ASP A 159
SER A 156
GLU A 153
ASP A 152
None
1.25A 3bc9A-3d31A:
undetectable
3bc9A-3d31A:
20.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3egw RESPIRATORY NITRATE
REDUCTASE 1 ALPHA
CHAIN


(Escherichia
coli)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
PF14710
(Nitr_red_alph_N)
4 SER A 782
SER A 777
GLU A1166
ASP A1103
None
0.95A 3bc9A-3egwA:
undetectable
3bc9A-3egwA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eyk HEMAGGLUTININ HA1
CHAIN


(Influenza A
virus)
PF00509
(Hemagglutinin)
4 ASP A  85
SER A 269
SER A 117
GLU A 119
None
1.25A 3bc9A-3eykA:
undetectable
3bc9A-3eykA:
18.90
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.
3fs4 HEMOGLOBIN SUBUNIT
BETA


(Struthio
camelus)
PF00042
(Globin)
4 ASP B  79
SER B   4
LYS B   8
GLU B   6
None
0.96A 3bc9A-3fs4B:
undetectable
3bc9A-3fs4B:
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.
3fy4 6-4 PHOTOLYASE

(Arabidopsis
thaliana)
PF00875
(DNA_photolyase)
PF03441
(FAD_binding_7)
4 SER A 172
SER A 140
GLU A 110
ASP A 112
None
1.31A 3bc9A-3fy4A:
undetectable
3bc9A-3fy4A:
21.68
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.
3gv0 TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY


(Agrobacterium
fabrum)
PF13377
(Peripla_BP_3)
4 ASP A  76
SER A  74
LYS A 132
GLU A 134
None
1.15A 3bc9A-3gv0A:
undetectable
3bc9A-3gv0A:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gwi MAGNESIUM-TRANSPORTI
NG ATPASE, P-TYPE 1


(Escherichia
coli)
PF13246
(Cation_ATPase)
4 ASP A 418
SER A 453
LYS A 468
GLU A 532
None
1.14A 3bc9A-3gwiA:
undetectable
3bc9A-3gwiA:
12.94
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.
3j08 COPPER-EXPORTING
P-TYPE ATPASE A


(Archaeoglobus
fulgidus)
PF00122
(E1-E2_ATPase)
PF00702
(Hydrolase)
4 ASP A 336
LYS A 328
GLU A 413
ASP A 410
None
0.89A 3bc9A-3j08A:
undetectable
3bc9A-3j08A:
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.
3llt SERINE/THREONINE
KINASE-1, PFLAMMER


(Plasmodium
falciparum)
PF00069
(Pkinase)
4 ASP A 752
SER A 754
SER A 864
GLU A 867
None
1.18A 3bc9A-3lltA:
undetectable
3bc9A-3lltA:
18.50
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.
3mm5 SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT ALPHA
SULFITE REDUCTASE,
DISSIMILATORY-TYPE
SUBUNIT BETA


(Archaeoglobus
fulgidus)
PF00037
(Fer4)
PF01077
(NIR_SIR)
PF03460
(NIR_SIR_ferr)
4 SER B 361
TRP A 325
GLU B 274
ASP A 222
None
1.24A 3bc9A-3mm5B:
undetectable
3bc9A-3mm5B:
17.86
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.
3oky PLEXIN-A2

(Mus musculus)
PF01403
(Sema)
PF01437
(PSI)
4 ASP A 120
SER A 122
SER A 175
ASP A 286
GOL  A2006 (-4.2A)
GOL  A2006 (-3.0A)
None
None
1.22A 3bc9A-3okyA:
5.4
3bc9A-3okyA:
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.
3qgk UREASE SUBUNIT BETA
2


(Helicobacter
mustelae)
PF00449
(Urease_alpha)
PF01979
(Amidohydro_1)
4 ASP C 133
SER C 298
GLU C 346
ASP C 347
None
1.17A 3bc9A-3qgkC:
4.1
3bc9A-3qgkC:
22.63
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.
3tbh O-ACETYL SERINE
SULFHYDRYLASE


(Leishmania
donovani)
PF00291
(PALP)
4 ASP A 267
SER A 266
GLU A 258
ASP A 255
None
1.30A 3bc9A-3tbhA:
undetectable
3bc9A-3tbhA:
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.
3tex PROTECTIVE ANTIGEN

(Bacillus
anthracis)
PF03495
(Binary_toxB)
PF07691
(PA14)
PF17475
(Binary_toxB_2)
PF17476
(Binary_toxB_3)
4 ASP A 520
SER A 221
GLU A 188
ASP A 185
None
CA  A 801 ( 4.6A)
CA  A 801 ( 2.4A)
None
1.17A 3bc9A-3texA:
4.7
3bc9A-3texA:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3umg HALOACID
DEHALOGENASE


(Rhodococcus
jostii)
PF00702
(Hydrolase)
4 ASP A  21
SER A 138
LYS A 169
ASP A  66
CL  A 255 (-3.7A)
CL  A 255 (-2.9A)
CL  A 255 ( 3.9A)
None
1.19A 3bc9A-3umgA:
undetectable
3bc9A-3umgA:
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.
3upu ATP-DEPENDENT DNA
HELICASE DDA


(Escherichia
virus T4)
PF13604
(AAA_30)
4 ASP A 332
SER A  71
LYS A  72
ASP A 115
None
1.29A 3bc9A-3upuA:
undetectable
3bc9A-3upuA:
22.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zvt D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Actinomadura
sp. R39)
PF02113
(Peptidase_S13)
4 SER A 379
SER A 288
TRP A 376
ASP A  66
None
1.18A 3bc9A-3zvtA:
undetectable
3bc9A-3zvtA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dsh UDP-GALACTOPYRANOSE
MUTASE


(Trypanosoma
cruzi)
PF01593
(Amino_oxidase)
PF13450
(NAD_binding_8)
4 ASP A  72
SER A  66
GLU A 443
ASP A 446
None
1.32A 3bc9A-4dshA:
undetectable
3bc9A-4dshA:
23.39
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.
4ed9 CAIB/BAIF FAMILY
PROTEIN


(Brucella suis)
PF02515
(CoA_transf_3)
4 ASP A  33
SER A  73
GLU A  38
ASP A  43
NHE  A 403 (-3.7A)
None
None
None
1.21A 3bc9A-4ed9A:
undetectable
3bc9A-4ed9A:
22.35
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.
4em7 DNA TOPOISOMERASE
IV, B SUBUNIT


(Streptococcus
pneumoniae)
PF02518
(HATPase_c)
4 ASP A  37
SER A  35
GLU A  47
ASP A  50
None
1.19A 3bc9A-4em7A:
undetectable
3bc9A-4em7A:
15.83
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.
4eps HYPOTHETICAL PROTEIN

(Bacteroides
ovatus)
PF13149
(Mfa_like_1)
4 ASP A 488
SER A 490
SER A 510
ASP A 466
GOL  A 627 ( 4.7A)
None
CL  A 604 ( 4.5A)
None
1.32A 3bc9A-4epsA:
undetectable
3bc9A-4epsA:
23.05
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.
4fur UREASE SUBUNIT GAMMA
2


(Brucella
abortus)
PF00547
(Urease_gamma)
4 ASP A  88
SER A  87
GLU A  55
ASP A  58
None
1.23A 3bc9A-4furA:
undetectable
3bc9A-4furA:
12.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4grl MHC CLASS II
HLA-DQ-ALPHA CHAIN


(Homo sapiens)
PF00993
(MHC_II_alpha)
PF07654
(C1-set)
4 SER A 144
SER A 139
GLU A  25
ASP A  29
None
1.33A 3bc9A-4grlA:
5.7
3bc9A-4grlA:
15.19
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.
4h7u PYRANOSE
DEHYDROGENASE


(Leucoagaricus
meleagris)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
4 SER A  32
SER A 226
LYS A 166
ASP A 215
None
1.30A 3bc9A-4h7uA:
undetectable
3bc9A-4h7uA:
21.21
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.
4jw0 CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN


(Gloeobacter
violaceus)
no annotation 4 ASP B  97
SER B  94
SER B  86
ASP B  88
None
1.23A 3bc9A-4jw0B:
undetectable
3bc9A-4jw0B:
11.03
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.
4kt6 NICOTINE ADENINE
DINUCLEOTIDE
GLYCOHYDROLASE


(Streptococcus
pyogenes)
PF07461
(NADase_NGA)
4 ASP A 308
LYS A 329
GLU A 326
ASP A 332
None
1.33A 3bc9A-4kt6A:
undetectable
3bc9A-4kt6A:
17.74
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.
4m0x CHLOROMUCONATE
CYCLOISOMERASE


(Rhodococcus
opacus)
PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C)
4 ASP A 113
SER A 356
SER A 304
GLU A 335
None
1.16A 3bc9A-4m0xA:
7.5
3bc9A-4m0xA:
20.20
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.
4oe6 DELTA-1-PYRROLINE-5-
CARBOXYLATE
DEHYDROGENASE,
MITOCHONDRIAL


(Saccharomyces
cerevisiae)
PF00171
(Aldedh)
4 ASP A 370
SER A 369
SER A 364
ASP A 471
None
1.14A 3bc9A-4oe6A:
undetectable
3bc9A-4oe6A:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4osp OXYGENASE-REDUCTASE

(Streptomyces
fradiae)
PF13561
(adh_short_C2)
4 SER A  15
SER A  38
GLU A  64
ASP A  70
NAP  A 301 (-2.7A)
NAP  A 301 (-4.4A)
NAP  A 301 (-4.0A)
None
1.26A 3bc9A-4ospA:
undetectable
3bc9A-4ospA:
18.45
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.
4puc SUSD HOMOLOG

(Bacteroides
uniformis)
PF12741
(SusD-like)
4 ASP A 171
SER A 158
GLU A 186
ASP A 185
None
1.30A 3bc9A-4pucA:
undetectable
3bc9A-4pucA:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4r40 PROTEIN TOLB

(Yersinia pestis)
PF04052
(TolB_N)
PF07676
(PD40)
4 ASP A 338
SER A 381
SER A 427
ASP A 210
None
1.22A 3bc9A-4r40A:
undetectable
3bc9A-4r40A:
21.31
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.
4url DNA TOPOISOMERASE
IV, B SUBUNIT


(Staphylococcus
aureus)
PF00204
(DNA_gyraseB)
PF02518
(HATPase_c)
4 ASP A  35
SER A  33
GLU A  45
ASP A  48
None
1.27A 3bc9A-4urlA:
undetectable
3bc9A-4urlA:
22.04
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.
4yxm DNA INTEGRITY
SCANNING PROTEIN
DISA


(Thermotoga
maritima)
PF00633
(HHH)
PF02457
(DisA_N)
PF10635
(DisA-linker)
4 ASP A 319
SER A 322
SER A 348
LYS A 351
None
1.33A 3bc9A-4yxmA:
undetectable
3bc9A-4yxmA:
21.02
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.
4zdk CTP SYNTHASE

(Mycobacterium
tuberculosis)
PF00117
(GATase)
PF06418
(CTP_synth_N)
4 SER A 529
SER A 319
GLU A  65
ASP A 315
None
None
None
ACP  A 602 ( 4.9A)
1.32A 3bc9A-4zdkA:
undetectable
3bc9A-4zdkA:
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.
5a3y THERMOLYSIN

(Bacillus
thermoproteolyticus)
PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
4 SER A 234
SER A 204
GLU A 187
ASP A 185
None
None
None
CA  A1319 ( 2.8A)
1.32A 3bc9A-5a3yA:
undetectable
3bc9A-5a3yA:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5chc DMSO REDUCTASE
FAMILY TYPE II
ENZYME,
MOLYBDOPTERIN
SUBUNIT


(Azospira oryzae)
PF00384
(Molybdopterin)
PF01568
(Molydop_binding)
4 SER A 575
SER A 570
GLU A 838
ASP A 775
None
0.86A 3bc9A-5chcA:
undetectable
3bc9A-5chcA:
22.17
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.
5cm8 RAS-RELATED PROTEIN
RAL-A


(Drosophila
melanogaster)
PF00071
(Ras)
4 ASP B  94
SER B  91
GLU B  70
ASP B  71
None
1.17A 3bc9A-5cm8B:
undetectable
3bc9A-5cm8B:
15.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dgq PUTATIVE
ENDOGLUCANASE-RELATE
D PROTEIN


(Photobacterium
profundum)
PF00759
(Glyco_hydro_9)
4 ASP A 143
SER A 145
SER A 222
TRP A 219
None
1.19A 3bc9A-5dgqA:
7.2
3bc9A-5dgqA:
22.26
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.
5dgq PUTATIVE
ENDOGLUCANASE-RELATE
D PROTEIN


(Photobacterium
profundum)
PF00759
(Glyco_hydro_9)
4 SER A 145
SER A 222
LYS A 221
TRP A 219
None
1.34A 3bc9A-5dgqA:
7.2
3bc9A-5dgqA:
22.26
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.
5erm FUSICOCCADIENE
SYNTHASE


(Diaporthe
amygdali)
no annotation 4 SER A 320
SER A 236
GLU A 240
ASP A  96
None
MG  A 405 ( 2.3A)
MG  A 405 (-2.5A)
MG  A 403 (-2.4A)
1.09A 3bc9A-5ermA:
undetectable
3bc9A-5ermA:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5fcs DIABODY

(Homo sapiens)
PF07686
(V-set)
4 SER H 153
SER H 221
TRP H 226
ASP L  51
None
1.32A 3bc9A-5fcsH:
6.8
3bc9A-5fcsH:
17.65
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.
5fui ENDO-1,3-BETA-GLUCAN
ASE, FAMILY GH16


(Zobellia
galactanivorans)
PF03422
(CBM_6)
4 ASP A 329
SER A 327
SER A 371
ASP A 276
APY  A 132 (-2.7A)
None
None
None
1.34A 3bc9A-5fuiA:
undetectable
3bc9A-5fuiA:
12.65
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.
5fxn THERMOLYSIN

(Bacillus
thermoproteolyticus)
PF01447
(Peptidase_M4)
PF02868
(Peptidase_M4_C)
4 SER A 234
SER A 204
GLU A 187
ASP A 185
None
None
None
CA  A1323 ( 2.8A)
1.33A 3bc9A-5fxnA:
undetectable
3bc9A-5fxnA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5giv CARBOXYPEPTIDASE 1

(Deinococcus
radiodurans)
PF02074
(Peptidase_M32)
4 ASP A 164
SER A 163
SER A 418
ASP A 407
None
1.15A 3bc9A-5givA:
undetectable
3bc9A-5givA:
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.
5gly GLYCOSIDE HYDROLASE
FAMILY 45 PROTEIN


(Thielavia
terrestris)
PF02015
(Glyco_hydro_45)
4 ASP A 115
SER A 118
SER A   7
ASP A 179
None
None
None
CTR  A 302 (-2.6A)
1.33A 3bc9A-5glyA:
undetectable
3bc9A-5glyA:
15.59
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.
5hcc COMPLEMENT C5

(Homo sapiens)
PF00207
(A2M)
PF01759
(NTR)
PF01821
(ANATO)
PF07677
(A2M_recep)
PF07678
(A2M_comp)
4 ASP A1063
SER A1065
SER A1075
GLU A1120
None
1.34A 3bc9A-5hccA:
3.4
3bc9A-5hccA:
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.
5hnm D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Enterococcus
faecalis)
PF02557
(VanY)
4 ASP A 195
SER A 143
GLU A 153
ASP A 156
ZN  A 301 ( 2.2A)
None
None
None
1.26A 3bc9A-5hnmA:
undetectable
3bc9A-5hnmA:
16.10
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.
5ify GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E


(Burkholderia
vietnamiensis)
PF00483
(NTP_transferase)
4 ASP A 201
SER A 204
SER A 158
GLU A 149
None
1.25A 3bc9A-5ifyA:
undetectable
3bc9A-5ifyA:
18.49
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.
5ipg BACTERIOFERRITIN
COMIGRATORY PROTEIN


(Xanthomonas
campestris)
PF00578
(AhpC-TSA)
4 ASP A  75
SER A  73
GLU A  51
ASP A  54
None
1.28A 3bc9A-5ipgA:
undetectable
3bc9A-5ipgA:
13.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5j5p DNA TOPOISOMERASE 4
SUBUNIT B


(Streptococcus
pneumoniae)
PF00204
(DNA_gyraseB)
PF02518
(HATPase_c)
4 ASP A  37
SER A  35
GLU A  47
ASP A  50
None
None
ANP  A 501 (-4.4A)
None
1.26A 3bc9A-5j5pA:
undetectable
3bc9A-5j5pA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jz7 BETA-NERVE GROWTH
FACTOR
MEDI578 SCFV, HEAVY
CHAIN


(Homo sapiens)
PF00243
(NGF)
PF07686
(V-set)
4 ASP C 101
SER C  95
SER A  19
ASP A 105
None
1.19A 3bc9A-5jz7C:
6.3
3bc9A-5jz7C:
11.98
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.
5ocy ACPA E4 FAB FRAGMENT
- LIGHT CHAIN


(Homo sapiens)
no annotation 4 ASP L 214
SER L 211
SER L 196
GLU L 207
None
1.34A 3bc9A-5ocyL:
6.3
3bc9A-5ocyL:
8.45
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.
5ojs TRANSCRIPTION-ASSOCI
ATED PROTEIN 1


(Saccharomyces
cerevisiae)
PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
4 ASP T1098
SER T1016
LYS T1019
ASP T2543
None
1.33A 3bc9A-5ojsT:
undetectable
3bc9A-5ojsT:
9.73
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.
5vrv PROTEIN REGULATED BY
ACID PH


(Agrobacterium
fabrum)
PF09924
(DUF2156)
4 ASP A 632
SER A 628
GLU A 596
ASP A 595
None
1.20A 3bc9A-5vrvA:
undetectable
3bc9A-5vrvA:
22.54
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.
5x9g MAGNESIUM
TRANSPORTER MGTE


(Thermus
thermophilus)
PF00571
(CBS)
PF03448
(MgtE_N)
4 ASP A 250
SER A  65
GLU A  68
ASP A  38
None
1.28A 3bc9A-5x9gA:
undetectable
3bc9A-5x9gA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y86 DUAL SPECIFICITY
TYROSINE-PHOSPHORYLA
TION-REGULATED
KINASE 3


(Homo sapiens)
no annotation 4 ASP A 506
SER A 508
SER A 387
GLU A 362
None
1.24A 3bc9A-5y86A:
undetectable
3bc9A-5y86A:
10.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yp3 DIPEPTIDYL
AMINOPEPTIDASE 4


(Pseudoxanthomonas
mexicana)
no annotation 4 SER A 334
SER A 356
TRP A 337
ASP A 343
None
1.27A 3bc9A-5yp3A:
undetectable
3bc9A-5yp3A:
9.22
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.
6dll P-HYDROXYBENZOATE
HYDROXYLASE


(Pseudomonas
putida)
no annotation 4 ASP A 229
SER A 264
TRP A 234
GLU A 262
None
1.10A 3bc9A-6dllA:
undetectable
3bc9A-6dllA:
9.21
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.
6fjy PROTEIN CSUE

(Acinetobacter
baumannii)
no annotation 4 ASP D  87
SER D  89
SER D 134
GLU D 148
None
0.99A 3bc9A-6fjyD:
2.7
3bc9A-6fjyD:
8.89
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.
6fsa -

(-)
no annotation 4 ASP A 599
SER A 271
LYS A 270
ASP A 282
None
FMT  A2004 (-2.7A)
None
None
1.26A 3bc9A-6fsaA:
undetectable
3bc9A-6fsaA:
undetectable