SIMILAR PATTERNS OF AMINO ACIDS FOR 2XDC_B_DVAB8

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.
1b0y PROTEIN (HIPIP)

(Allochromatium
vinosum) 		PF01355
(HIPIP) 		3 TRP A  76
VAL A  73
TRP A  80
 None
 1.31A 2xdcA-1b0yA:
undetectable
2xdcB-1b0yA:
undetectable		 2xdcA-1b0yA:
8.64
2xdcB-1b0yA:
8.64
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.
1b0y PROTEIN (HIPIP)

(Allochromatium
vinosum) 		PF01355
(HIPIP) 		3 TRP A  80
VAL A  73
TRP A  76
 None
 1.27A 2xdcA-1b0yA:
undetectable
2xdcB-1b0yA:
undetectable		 2xdcA-1b0yA:
8.64
2xdcB-1b0yA:
8.64
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.
1c3a FLAVOCETIN-A: ALPHA
SUBUNIT

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  69
VAL A 128
TRP A  25
 None
 1.15A 2xdcA-1c3aA:
undetectable
2xdcB-1c3aA:
undetectable		 2xdcA-1c3aA:
8.55
2xdcB-1c3aA:
8.55
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.
1clx XYLANASE A

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10) 		3 TRP A 313
VAL A 249
TRP A 305
 None
 1.32A 2xdcA-1clxA:
undetectable
2xdcB-1clxA:
undetectable		 2xdcA-1clxA:
8.70
2xdcB-1clxA:
8.70
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.
1dv8 ASIALOGLYCOPROTEIN
RECEPTOR 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 174
VAL A 275
TRP A 210
 None
 1.37A 2xdcA-1dv8A:
undetectable
2xdcB-1dv8A:
undetectable		 2xdcA-1dv8A:
15.94
2xdcB-1dv8A:
15.94
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.
1dv8 ASIALOGLYCOPROTEIN
RECEPTOR 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 210
VAL A 275
TRP A 174
 None
 1.13A 2xdcA-1dv8A:
undetectable
2xdcB-1dv8A:
undetectable		 2xdcA-1dv8A:
15.94
2xdcB-1dv8A:
15.94
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.
1eqc EXO-(B)-(1,3)-GLUCAN
ASE

(Candida
albicans) 		PF00150
(Cellulase) 		3 TRP A  23
VAL A  25
TRP A  74
 None
 0.99A 2xdcA-1eqcA:
undetectable
2xdcB-1eqcA:
undetectable		 2xdcA-1eqcA:
4.33
2xdcB-1eqcA:
4.33
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.
1fbw ENDO-1,4-BETA-GLUCAN
ASE F

([Clostridium]
cellulolyticum) 		PF02011
(Glyco_hydro_48) 		3 TRP A  62
VAL A 236
TRP A 241
 None
 1.32A 2xdcA-1fbwA:
undetectable
2xdcB-1fbwA:
undetectable		 2xdcA-1fbwA:
5.22
2xdcB-1fbwA:
5.22
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.
1gz2 OVOCLEIDIN-17

(Gallus gallus) 		PF00059
(Lectin_C) 		3 TRP A  76
VAL A 137
TRP A  26
 None
 1.30A 2xdcA-1gz2A:
undetectable
2xdcB-1gz2A:
undetectable		 2xdcA-1gz2A:
13.41
2xdcB-1gz2A:
13.41
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.
1hn0 CHONDROITIN ABC
LYASE I

(Proteus
vulgaris) 		PF02278
(Lyase_8)
PF02884
(Lyase_8_C)
PF09092
(Lyase_N)
PF09093
(Lyase_catalyt) 		3 TRP A 690
VAL A 843
TRP A 688
 None
 1.22A 2xdcA-1hn0A:
undetectable
2xdcB-1hn0A:
undetectable		 2xdcA-1hn0A:
1.98
2xdcB-1hn0A:
1.98
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.
1ijk BOTROCETIN

(Bothrops
jararaca) 		PF00059
(Lectin_C) 		3 TRP B  23
VAL B 127
TRP B  68
 None
 1.46A 2xdcA-1ijkB:
undetectable
2xdcB-1ijkB:
undetectable		 2xdcA-1ijkB:
12.20
2xdcB-1ijkB:
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.
1ijk BOTROCETIN

(Bothrops
jararaca) 		PF00059
(Lectin_C) 		3 TRP B  68
VAL B 127
TRP B  23
 None
 1.17A 2xdcA-1ijkB:
undetectable
2xdcB-1ijkB:
undetectable		 2xdcA-1ijkB:
12.20
2xdcB-1ijkB:
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.
1ixx COAGULATION FACTORS
IX/X-BINDING PROTEIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  23
VAL A 126
TRP A  67
 None
 1.45A 2xdcA-1ixxA:
undetectable
2xdcB-1ixxA:
undetectable		 2xdcA-1ixxA:
11.49
2xdcB-1ixxA:
11.49
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.
1ixx COAGULATION FACTORS
IX/X-BINDING PROTEIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A 126
TRP A  23
 None
 1.20A 2xdcA-1ixxA:
undetectable
2xdcB-1ixxA:
undetectable		 2xdcA-1ixxA:
11.49
2xdcB-1ixxA:
11.49
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.
1jwi PLATELET AGGREGATION
INDUCER

(Bitis arietans) 		PF00059
(Lectin_C) 		3 TRP B  25
VAL B 120
TRP B  67
 None
 1.45A 2xdcA-1jwiB:
undetectable
2xdcB-1jwiB:
undetectable		 2xdcA-1jwiB:
13.41
2xdcB-1jwiB:
13.41
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.
1jwi PLATELET AGGREGATION
INDUCER

(Bitis arietans) 		PF00059
(Lectin_C) 		3 TRP B  67
VAL B 120
TRP B  25
 None
 1.15A 2xdcA-1jwiB:
undetectable
2xdcB-1jwiB:
undetectable		 2xdcA-1jwiB:
13.41
2xdcB-1jwiB:
13.41
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.
1oz7 ECHICETIN B-CHAIN

(Echis carinatus) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B 118
TRP B  23
 None
 1.25A 2xdcA-1oz7B:
undetectable
2xdcB-1oz7B:
undetectable		 2xdcA-1oz7B:
26.67
2xdcB-1oz7B:
26.67
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.
1qdd LITHOSTATHINE

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A  77
VAL A 139
TRP A  35
 None
 1.20A 2xdcA-1qddA:
undetectable
2xdcB-1qddA:
undetectable		 2xdcA-1qddA:
17.54
2xdcB-1qddA:
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.
1u0o BOTROCETIN

(Bothrops
jararaca) 		PF00059
(Lectin_C) 		3 TRP B 265
VAL B 320
TRP B 223
 None
 1.28A 2xdcA-1u0oB:
undetectable
2xdcB-1u0oB:
undetectable		 2xdcA-1u0oB:
9.17
2xdcB-1u0oB:
9.17
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.
1ukm EMS16 A CHAIN

(Echis
multisquamatus) 		PF00059
(Lectin_C) 		3 TRP A  69
VAL A 128
TRP A  25
 None
 1.26A 2xdcA-1ukmA:
undetectable
2xdcB-1ukmA:
undetectable		 2xdcA-1ukmA:
9.91
2xdcB-1ukmA:
9.91
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.
1umr CONVULXIN BETA

(Crotalus
durissus) 		PF00059
(Lectin_C) 		3 TRP C 225
VAL C 320
TRP C 267
 None
 1.37A 2xdcA-1umrC:
undetectable
2xdcB-1umrC:
undetectable		 2xdcA-1umrC:
10.19
2xdcB-1umrC:
10.19
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.
1umr CONVULXIN BETA

(Crotalus
durissus) 		PF00059
(Lectin_C) 		3 TRP C 267
VAL C 320
TRP C 225
 None
 1.09A 2xdcA-1umrC:
undetectable
2xdcB-1umrC:
undetectable		 2xdcA-1umrC:
10.19
2xdcB-1umrC:
10.19
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.
1ur1 ENDOXYLANASE

(Cellvibrio
mixtus) 		PF00331
(Glyco_hydro_10) 		3 TRP A 336
VAL A 265
TRP A 328
 XYS  A1376 ( 3.9A)
None
XYS  A1376 ( 4.1A)
 1.34A 2xdcA-1ur1A:
undetectable
2xdcB-1ur1A:
undetectable		 2xdcA-1ur1A:
5.46
2xdcB-1ur1A:
5.46
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.
1us2 ENDO-BETA-1,4-XYLANA
SE

(Cellvibrio
japonicus) 		PF00331
(Glyco_hydro_10)
PF03426
(CBM_15) 		3 TRP A 560
VAL A 500
TRP A 552
 XYP  A1609 ( 4.0A)
None
XYP  A1609 ( 4.1A)
 1.34A 2xdcA-1us2A:
undetectable
2xdcB-1us2A:
undetectable		 2xdcA-1us2A:
3.14
2xdcB-1us2A:
3.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1v4l MUCROCETIN BETA
CHAIN

(Protobothrops
mucrosquamatus) 		PF00059
(Lectin_C) 		3 TRP B 267
VAL B 320
TRP B 225
 None
 1.25A 2xdcA-1v4lB:
undetectable
2xdcB-1v4lB:
undetectable		 2xdcA-1v4lB:
8.00
2xdcB-1v4lB:
8.00
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.
1wt9 ANTICOAGULANT
PROTEIN-B

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP B  23
VAL B 118
TRP B  65
 None
 1.44A 2xdcA-1wt9B:
undetectable
2xdcB-1wt9B:
undetectable		 2xdcA-1wt9B:
13.75
2xdcB-1wt9B:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wt9 ANTICOAGULANT
PROTEIN-B

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B 118
TRP B  23
 None
 1.19A 2xdcA-1wt9B:
undetectable
2xdcB-1wt9B:
undetectable		 2xdcA-1wt9B:
13.75
2xdcB-1wt9B:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x2w COAGULATION FACTOR
IX/FACTOR X-BINDING
PROTEIN B CHAIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP B  23
VAL B 118
TRP B  65
 None
 1.43A 2xdcA-1x2wB:
undetectable
2xdcB-1x2wB:
undetectable		 2xdcA-1x2wB:
13.75
2xdcB-1x2wB:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x2w COAGULATION FACTOR
IX/FACTOR X-BINDING
PROTEIN B CHAIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B 118
TRP B  23
 None
 1.14A 2xdcA-1x2wB:
undetectable
2xdcB-1x2wB:
undetectable		 2xdcA-1x2wB:
13.75
2xdcB-1x2wB:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1x2w COAGULATION FACTOR
IX/X-BINDING PROTEIN
A CHAIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  23
VAL A 126
TRP A  67
 None
 1.47A 2xdcA-1x2wA:
undetectable
2xdcB-1x2wA:
undetectable		 2xdcA-1x2wA:
10.43
2xdcB-1x2wA:
10.43
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.
1x2w COAGULATION FACTOR
IX/X-BINDING PROTEIN
A CHAIN

(Protobothrops
flavoviridis) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A 126
TRP A  23
 None
 1.17A 2xdcA-1x2wA:
undetectable
2xdcB-1x2wA:
undetectable		 2xdcA-1x2wA:
10.43
2xdcB-1x2wA:
10.43
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.
1y17 ANTICOAGULANT
PROTEIN A

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A 126
TRP A  23
 None
 1.24A 2xdcA-1y17A:
undetectable
2xdcB-1y17A:
undetectable		 2xdcA-1y17A:
9.57
2xdcB-1y17A:
9.57
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.
2afp PROTEIN (SEA RAVEN
TYPE II ANTIFREEZE
PROTEIN)

(Hemitripterus
americanus) 		PF00059
(Lectin_C) 		3 TRP A  63
VAL A 124
TRP A  28
 None
 1.28A 2xdcA-2afpA:
undetectable
2xdcB-2afpA:
undetectable		 2xdcA-2afpA:
10.62
2xdcB-2afpA:
10.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ams HIGH POTENTIAL
IRON-SULFUR PROTEIN

(Allochromatium
vinosum) 		PF01355
(HIPIP) 		3 TRP A  74
VAL A  71
TRP A  78
 None
 1.22A 2xdcA-2amsA:
undetectable
2xdcB-2amsA:
undetectable		 2xdcA-2amsA:
10.96
2xdcB-2amsA:
10.96
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.
2ams HIGH POTENTIAL
IRON-SULFUR PROTEIN

(Allochromatium
vinosum) 		PF01355
(HIPIP) 		3 TRP A  78
VAL A  71
TRP A  74
 None
 1.14A 2xdcA-2amsA:
undetectable
2xdcB-2amsA:
undetectable		 2xdcA-2amsA:
10.96
2xdcB-2amsA:
10.96
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.
2e3x COAGULATION FACTOR
X-ACTIVATING ENZYME
LIGHT CHAIN 1

(Daboia
siamensis) 		PF00059
(Lectin_C) 		3 TRP C  25
VAL C 120
TRP C  67
 None
 1.44A 2xdcA-2e3xC:
undetectable
2xdcB-2e3xC:
undetectable		 2xdcA-2e3xC:
13.51
2xdcB-2e3xC:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e3x COAGULATION FACTOR
X-ACTIVATING ENZYME
LIGHT CHAIN 1

(Daboia
siamensis) 		PF00059
(Lectin_C) 		3 TRP C  67
VAL C 120
TRP C  25
 None
 1.16A 2xdcA-2e3xC:
undetectable
2xdcB-2e3xC:
undetectable		 2xdcA-2e3xC:
13.51
2xdcB-2e3xC:
13.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e3x COAGULATION FACTOR
X-ACTIVATING ENZYME
LIGHT CHAIN 2

(Daboia
siamensis) 		PF00059
(Lectin_C) 		3 TRP B  67
VAL B 126
TRP B  23
 None
 1.35A 2xdcA-2e3xB:
undetectable
2xdcB-2e3xB:
undetectable		 2xdcA-2e3xB:
10.00
2xdcB-2e3xB:
10.00
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.
2go0 REGENERATING
ISLET-DERIVED
PROTEIN 3 ALPHA

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A  65
VAL A 132
TRP A  23
 None
 1.28A 2xdcA-2go0A:
undetectable
2xdcB-2go0A:
undetectable		 2xdcA-2go0A:
9.41
2xdcB-2go0A:
9.41
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.
2h2t LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR
(LYMPHOCYTE IGE
RECEPTOR)
(FC-EPSILON-RII)
(IMMUNOGLOBULIN
E-BINDING FACTOR)
(CD23 ANTIGEN)

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP B 184
VAL B 281
TRP B 220
 None
 1.47A 2xdcA-2h2tB:
undetectable
2xdcB-2h2tB:
undetectable		 2xdcA-2h2tB:
4.38
2xdcB-2h2tB:
4.38
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.
2h2t LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR
(LYMPHOCYTE IGE
RECEPTOR)
(FC-EPSILON-RII)
(IMMUNOGLOBULIN
E-BINDING FACTOR)
(CD23 ANTIGEN)

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP B 220
VAL B 281
TRP B 184
 None
 1.23A 2xdcA-2h2tB:
undetectable
2xdcB-2h2tB:
undetectable		 2xdcA-2h2tB:
4.38
2xdcB-2h2tB:
4.38
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.
2m9l BETA-THERAPHOTOXIN-T
P1A

(Thrixopelma
pruriens) 		PF07740
(Toxin_12) 		3 TRP A   5
VAL A  20
TRP A  27
 None
 1.26A 2xdcA-2m9lA:
undetectable
2xdcB-2m9lA:
undetectable		 2xdcA-2m9lA:
14.29
2xdcB-2m9lA:
14.29
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.
2p3x POLYPHENOL OXIDASE,
CHLOROPLAST

(Vitis vinifera) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		3 TRP A 111
VAL A 107
TRP A 298
 None
 1.37A 2xdcA-2p3xA:
undetectable
2xdcB-2p3xA:
undetectable		 2xdcA-2p3xA:
4.02
2xdcB-2p3xA:
4.02
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.
2p3x POLYPHENOL OXIDASE,
CHLOROPLAST

(Vitis vinifera) 		PF00264
(Tyrosinase)
PF12142
(PPO1_DWL) 		3 TRP A 298
VAL A 107
TRP A 111
 None
 1.47A 2xdcA-2p3xA:
undetectable
2xdcB-2p3xA:
undetectable		 2xdcA-2p3xA:
4.02
2xdcB-2p3xA:
4.02
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.
2r1f PREDICTED
AMINODEOXYCHORISMATE
LYASE

(Escherichia
coli) 		PF02618
(YceG) 		3 TRP A 162
VAL A 115
TRP A 166
 None
 1.44A 2xdcA-2r1fA:
undetectable
2xdcB-2r1fA:
undetectable		 2xdcA-2r1fA:
11.59
2xdcB-2r1fA:
11.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r1f PREDICTED
AMINODEOXYCHORISMATE
LYASE

(Escherichia
coli) 		PF02618
(YceG) 		3 TRP A 166
VAL A 115
TRP A 162
 None
 1.41A 2xdcA-2r1fA:
undetectable
2xdcB-2r1fA:
undetectable		 2xdcA-2r1fA:
11.59
2xdcB-2r1fA:
11.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2vrp AGGRETIN BETA CHAIN

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B 118
TRP B  23
 None
 1.22A 2xdcA-2vrpB:
undetectable
2xdcB-2vrpB:
undetectable		 2xdcA-2vrpB:
12.50
2xdcB-2vrpB:
12.50
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.
3bx4 AGGRETIN BETA CHAIN

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP B  23
VAL B 118
TRP B  65
 None
 1.41A 2xdcA-3bx4B:
undetectable
2xdcB-3bx4B:
undetectable		 2xdcA-3bx4B:
9.71
2xdcB-3bx4B:
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.
3bx4 AGGRETIN BETA CHAIN

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP B  65
VAL B 118
TRP B  23
 None
 1.15A 2xdcA-3bx4B:
undetectable
2xdcB-3bx4B:
undetectable		 2xdcA-3bx4B:
9.71
2xdcB-3bx4B:
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.
3c4a PROBABLE TRYPTOPHAN
HYDROXYLASE VIOD

(Chromobacterium
violaceum) 		no annotation 3 TRP A  42
VAL A 203
TRP A 165
 None
None
FAD  A 401 (-4.0A)
 1.22A 2xdcA-3c4aA:
undetectable
2xdcB-3c4aA:
undetectable		 2xdcA-3c4aA:
4.76
2xdcB-3c4aA:
4.76
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.
3c4a PROBABLE TRYPTOPHAN
HYDROXYLASE VIOD

(Chromobacterium
violaceum) 		no annotation 3 TRP A 165
VAL A 203
TRP A  42
 FAD  A 401 (-4.0A)
None
None
 0.99A 2xdcA-3c4aA:
undetectable
2xdcB-3c4aA:
undetectable		 2xdcA-3c4aA:
4.76
2xdcB-3c4aA:
4.76
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.
3ew2 RHIZAVIDIN

(Rhizobium etli) 		PF01382
(Avidin) 		3 TRP A  85
VAL A  99
TRP A 102
 BTN  A 400 ( 4.7A)
None
BTN  A 400 (-3.3A)
 0.95A 2xdcA-3ew2A:
undetectable
2xdcB-3ew2A:
undetectable		 2xdcA-3ew2A:
13.64
2xdcB-3ew2A:
13.64
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.
3ew2 RHIZAVIDIN

(Rhizobium etli) 		PF01382
(Avidin) 		3 TRP A 102
VAL A  99
TRP A  85
 BTN  A 400 (-3.3A)
None
BTN  A 400 ( 4.7A)
 1.04A 2xdcA-3ew2A:
undetectable
2xdcB-3ew2A:
undetectable		 2xdcA-3ew2A:
13.64
2xdcB-3ew2A:
13.64
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.
3ff7 KILLER CELL
LECTIN-LIKE RECEPTOR
SUBFAMILY G MEMBER 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP C 132
VAL C 183
TRP C  96
 None
 1.23A 2xdcA-3ff7C:
undetectable
2xdcB-3ff7C:
undetectable		 2xdcA-3ff7C:
9.17
2xdcB-3ff7C:
9.17
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.
3hft WBMS, POLYSACCHARIDE
DEACETYLASE INVOLVED
IN O-ANTIGEN
BIOSYNTHESIS

(Bordetella
bronchiseptica) 		no annotation 3 TRP A 153
VAL A 151
TRP A 176
 None
 1.10A 2xdcA-3hftA:
undetectable
2xdcB-3hftA:
undetectable		 2xdcA-3hftA:
9.45
2xdcB-3hftA:
9.45
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.
3hft WBMS, POLYSACCHARIDE
DEACETYLASE INVOLVED
IN O-ANTIGEN
BIOSYNTHESIS

(Bordetella
bronchiseptica) 		no annotation 3 TRP A 176
VAL A 203
TRP A 153
 None
 1.37A 2xdcA-3hftA:
undetectable
2xdcB-3hftA:
undetectable		 2xdcA-3hftA:
9.45
2xdcB-3hftA:
9.45
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.
3msg INTRA-CELLULAR
XYLANASE IXT6

(Geobacillus
stearothermophilus) 		PF00331
(Glyco_hydro_10) 		3 TRP A 299
VAL A 244
TRP A 291
 XYP  A 450 ( 4.0A)
None
XYP  A 450 ( 4.1A)
 1.41A 2xdcA-3msgA:
undetectable
2xdcB-3msgA:
undetectable		 2xdcA-3msgA:
4.10
2xdcB-3msgA:
4.10
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.
3rjy ENDOGLUCANASE
FNCEL5A

(Fervidobacterium
nodosum) 		PF00150
(Cellulase) 		3 TRP A 251
VAL A 249
TRP A 298
 None
 1.36A 2xdcA-3rjyA:
undetectable
2xdcB-3rjyA:
undetectable		 2xdcA-3rjyA:
2.85
2xdcB-3rjyA:
2.85
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.
3t2x AVIDIN/STREPTAVIDIN

(Shewanella
denitrificans) 		PF01382
(Avidin) 		3 TRP A  80
VAL A 116
TRP A  97
 None
 1.18A 2xdcA-3t2xA:
undetectable
2xdcB-3t2xA:
undetectable		 2xdcA-3t2xA:
12.94
2xdcB-3t2xA:
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.
3t2x AVIDIN/STREPTAVIDIN

(Shewanella
denitrificans) 		PF01382
(Avidin) 		3 TRP A  97
VAL A 116
TRP A  80
 None
 1.21A 2xdcA-3t2xA:
undetectable
2xdcB-3t2xA:
undetectable		 2xdcA-3t2xA:
12.94
2xdcB-3t2xA:
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.
3ta7 ATP-DEPENDENT DNA
LIGASE, N-TERMINAL
DOMAIN PROTEIN

(Candidatus
Korarchaeum
cryptofilum) 		PF13298
(LigD_N) 		3 TRP A  16
VAL A  72
TRP A  75
 None
 1.43A 2xdcA-3ta7A:
undetectable
2xdcB-3ta7A:
undetectable		 2xdcA-3ta7A:
10.39
2xdcB-3ta7A:
10.39
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.
3ubu AGGLUCETIN SUBUNIT
ALPHA-1

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP A  67
VAL A 126
TRP A  25
 None
 1.23A 2xdcA-3ubuA:
undetectable
2xdcB-3ubuA:
undetectable		 2xdcA-3ubuA:
9.23
2xdcB-3ubuA:
9.23
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.
3ubu AGGLUCETIN SUBUNIT
BETA-2

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP B  25
VAL B 121
TRP B  67
 None
 1.42A 2xdcA-3ubuB:
undetectable
2xdcB-3ubuB:
undetectable		 2xdcA-3ubuB:
9.17
2xdcB-3ubuB:
9.17
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.
3ubu AGGLUCETIN SUBUNIT
BETA-2

(Deinagkistrodon
acutus) 		PF00059
(Lectin_C) 		3 TRP B  67
VAL B 121
TRP B  25
 None
 1.14A 2xdcA-3ubuB:
undetectable
2xdcB-3ubuB:
undetectable		 2xdcA-3ubuB:
9.17
2xdcB-3ubuB:
9.17
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.
3v4b STARVATION SENSING
PROTEIN RSPA

(Cellvibrio
japonicus) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 400
VAL A 391
TRP A 181
 None
 1.21A 2xdcA-3v4bA:
undetectable
2xdcB-3v4bA:
undetectable		 2xdcA-3v4bA:
4.04
2xdcB-3v4bA:
4.04
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.
3v8x TRANSFERRIN-BINDING
PROTEIN 1

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 TRP A 744
VAL A 747
TRP A 755
 None
 1.31A 2xdcA-3v8xA:
undetectable
2xdcB-3v8xA:
undetectable		 2xdcA-3v8xA:
2.21
2xdcB-3v8xA:
2.21
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.
3v8x TRANSFERRIN-BINDING
PROTEIN 1

(Neisseria
meningitidis) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		3 TRP A 755
VAL A 747
TRP A 744
 None
 1.43A 2xdcA-3v8xA:
undetectable
2xdcB-3v8xA:
undetectable		 2xdcA-3v8xA:
2.21
2xdcB-3v8xA:
2.21
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.
3w25 GLYCOSIDE HYDROLASE
FAMILY 10

(Thermoanaerobacterium
saccharolyticum) 		PF00331
(Glyco_hydro_10) 		3 TRP A 292
VAL A 298
TRP A 300
 XYP  A 401 (-4.2A)
None
XYP  A 402 (-4.1A)
 1.14A 2xdcA-3w25A:
undetectable
2xdcB-3w25A:
undetectable		 2xdcA-3w25A:
3.79
2xdcB-3w25A:
3.79
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.
3w25 GLYCOSIDE HYDROLASE
FAMILY 10

(Thermoanaerobacterium
saccharolyticum) 		PF00331
(Glyco_hydro_10) 		3 TRP A 300
VAL A 298
TRP A 292
 XYP  A 402 (-4.1A)
None
XYP  A 401 (-4.2A)
 1.16A 2xdcA-3w25A:
undetectable
2xdcB-3w25A:
undetectable		 2xdcA-3w25A:
3.79
2xdcB-3w25A:
3.79
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.
3wwk SNACLEC RHODOCYTIN
SUBUNIT ALPHA

(Calloselasma
rhodostoma) 		PF00059
(Lectin_C) 		3 TRP A  71
VAL A 130
TRP A  26
 None
 1.24A 2xdcA-3wwkA:
undetectable
2xdcB-3wwkA:
undetectable		 2xdcA-3wwkA:
8.09
2xdcB-3wwkA:
8.09
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.
4e4f MANNONATE
DEHYDRATASE

(Pectobacterium
carotovorum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 402
VAL A 393
TRP A 183
 GOL  A 505 (-4.6A)
None
None
 1.20A 2xdcA-4e4fA:
undetectable
2xdcB-4e4fA:
undetectable		 2xdcA-4e4fA:
2.65
2xdcB-4e4fA:
2.65
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.
4ew6 D-GALACTOSE-1-DEHYDR
OGENASE PROTEIN

(Rhizobium etli) 		PF01408
(GFO_IDH_MocA) 		3 TRP A 144
VAL A 166
TRP A 230
 None
 1.26A 2xdcA-4ew6A:
undetectable
2xdcB-4ew6A:
undetectable		 2xdcA-4ew6A:
5.58
2xdcB-4ew6A:
5.58
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.
4il2 STARVATION SENSING
PROTEIN RSPA

(Escherichia
coli) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 413
VAL A 404
TRP A 194
 None
 1.20A 2xdcA-4il2A:
undetectable
2xdcB-4il2A:
undetectable		 2xdcA-4il2A:
2.75
2xdcB-4il2A:
2.75
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.
4j6p LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 220
VAL A 281
TRP A 184
 None
 1.23A 2xdcA-4j6pA:
undetectable
2xdcB-4j6pA:
undetectable		 2xdcA-4j6pA:
10.00
2xdcB-4j6pA:
10.00
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.
4kws D-MANNONATE
DEHYDRATASE

(Chromohalobacter
salexigens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		3 TRP A 403
VAL A 394
TRP A 184
 None
 1.21A 2xdcA-4kwsA:
undetectable
2xdcB-4kwsA:
undetectable		 2xdcA-4kwsA:
3.41
2xdcB-4kwsA:
3.41
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.
4m1r CELLULASE 5

(soil metagenome) 		PF00150
(Cellulase) 		3 TRP A  46
VAL A  44
TRP A  51
 None
 0.96A 2xdcA-4m1rA:
undetectable
2xdcB-4m1rA:
undetectable		 2xdcA-4m1rA:
4.56
2xdcB-4m1rA:
4.56
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.
4m1r CELLULASE 5

(soil metagenome) 		PF00150
(Cellulase) 		3 TRP A  51
VAL A  44
TRP A  46
 None
 1.10A 2xdcA-4m1rA:
undetectable
2xdcB-4m1rA:
undetectable		 2xdcA-4m1rA:
4.56
2xdcB-4m1rA:
4.56
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.
4nk6 POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF13229
(Beta_helix) 		3 TRP A 280
VAL A 303
TRP A 240
 MLY  A  89 ( 4.8A)
MLY  A 304 ( 3.2A)
MLY  A  89 ( 3.7A)
 1.40A 2xdcA-4nk6A:
undetectable
2xdcB-4nk6A:
undetectable		 2xdcA-4nk6A:
3.34
2xdcB-4nk6A:
3.34
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.
4pue ENDO-1,4-BETA-XYLANA
SE

(Geobacillus
stearothermophilus) 		PF00331
(Glyco_hydro_10) 		3 TRP A 324
VAL A 268
TRP A 316
 XYP  A 403 (-4.0A)
None
XYP  A 404 (-4.0A)
 1.26A 2xdcA-4pueA:
undetectable
2xdcB-4pueA:
undetectable		 2xdcA-4pueA:
3.28
2xdcB-4pueA:
3.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ao5 C-TYPE MANNOSE
RECEPTOR 2

(Homo sapiens) 		PF00040
(fn2)
PF00059
(Lectin_C) 		3 TRP A 297
VAL A 358
TRP A 259
 None
 1.22A 2xdcA-5ao5A:
undetectable
2xdcB-5ao5A:
undetectable		 2xdcA-5ao5A:
3.25
2xdcB-5ao5A:
3.25
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1

(Pseudomonas
stutzeri) 		PF00115
(COX1) 		3 TRP A 341
VAL A 346
TRP A 400
 None
HEM  A 501 ( 3.8A)
None
 1.13A 2xdcA-5djqA:
undetectable
2xdcB-5djqA:
undetectable		 2xdcA-5djqA:
3.73
2xdcB-5djqA:
3.73
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.
5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1

(Pseudomonas
stutzeri) 		PF00115
(COX1) 		3 TRP A 400
VAL A 346
TRP A 341
 None
HEM  A 501 ( 3.8A)
None
 1.12A 2xdcA-5djqA:
undetectable
2xdcB-5djqA:
undetectable		 2xdcA-5djqA:
3.73
2xdcB-5djqA:
3.73
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.
5e3x THERMOSTABLE
CARBOXYPEPTIDASE 1

(Fervidobacterium
islandicum) 		PF02074
(Peptidase_M32) 		3 TRP A 300
VAL A 293
TRP A 323
 None
 0.92A 2xdcA-5e3xA:
undetectable
2xdcB-5e3xA:
undetectable		 2xdcA-5e3xA:
5.65
2xdcB-5e3xA:
5.65
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.
5e3x THERMOSTABLE
CARBOXYPEPTIDASE 1

(Fervidobacterium
islandicum) 		PF02074
(Peptidase_M32) 		3 TRP A 323
VAL A 292
TRP A 300
 None
 1.16A 2xdcA-5e3xA:
undetectable
2xdcB-5e3xA:
undetectable		 2xdcA-5e3xA:
5.65
2xdcB-5e3xA:
5.65
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.
5e3x THERMOSTABLE
CARBOXYPEPTIDASE 1

(Fervidobacterium
islandicum) 		PF02074
(Peptidase_M32) 		3 TRP A 323
VAL A 293
TRP A 300
 None
 1.10A 2xdcA-5e3xA:
undetectable
2xdcB-5e3xA:
undetectable		 2xdcA-5e3xA:
5.65
2xdcB-5e3xA:
5.65
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.
5ihs ENDOGLUCANASE,
GLYCOSIDE HYDROLASE
FAMILY 5 PROTEIN

(Cytophaga
hutchinsonii) 		PF00150
(Cellulase) 		3 TRP A  73
VAL A  71
TRP A  78
 None
 0.81A 2xdcA-5ihsA:
undetectable
2xdcB-5ihsA:
undetectable		 2xdcA-5ihsA:
4.71
2xdcB-5ihsA:
4.71
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.
5ihs ENDOGLUCANASE,
GLYCOSIDE HYDROLASE
FAMILY 5 PROTEIN

(Cytophaga
hutchinsonii) 		PF00150
(Cellulase) 		3 TRP A  78
VAL A  71
TRP A  73
 None
 0.95A 2xdcA-5ihsA:
undetectable
2xdcB-5ihsA:
undetectable		 2xdcA-5ihsA:
4.71
2xdcB-5ihsA:
4.71
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.
5jpv ASIALOGLYCOPROTEIN
RECEPTOR 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 174
VAL A 275
TRP A 210
 None
 1.43A 2xdcA-5jpvA:
undetectable
2xdcB-5jpvA:
undetectable		 2xdcA-5jpvA:
12.82
2xdcB-5jpvA:
12.82
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.
5jpv ASIALOGLYCOPROTEIN
RECEPTOR 1

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP A 210
VAL A 275
TRP A 174
 None
 1.19A 2xdcA-5jpvA:
undetectable
2xdcB-5jpvA:
undetectable		 2xdcA-5jpvA:
12.82
2xdcB-5jpvA:
12.82
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.
5lgk LOW AFFINITY
IMMUNOGLOBULIN
EPSILON FC RECEPTOR

(Homo sapiens) 		PF00059
(Lectin_C) 		3 TRP E 220
VAL E 281
TRP E 184
 None
 1.26A 2xdcA-5lgkE:
undetectable
2xdcB-5lgkE:
undetectable		 2xdcA-5lgkE:
8.25
2xdcB-5lgkE:
8.25
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.
5oee LARGE SUBUNIT
TERMINASE

(Phage D6E) 		no annotation 3 TRP A  24
VAL A  50
TRP A  25
 None
 1.37A 2xdcA-5oeeA:
undetectable
2xdcB-5oeeA:
undetectable		 2xdcA-5oeeA:
3.94
2xdcB-5oeeA:
3.94
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.
5oee LARGE SUBUNIT
TERMINASE

(Phage D6E) 		no annotation 3 TRP A  25
VAL A  50
TRP A  24
 None
 1.40A 2xdcA-5oeeA:
undetectable
2xdcB-5oeeA:
undetectable		 2xdcA-5oeeA:
3.94
2xdcB-5oeeA:
3.94
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.
5wxi EARP

(Neisseria
meningitidis) 		no annotation 3 TRP A  71
VAL A  46
TRP A  42
 None
SO4  A 406 (-3.9A)
None
 1.19A 2xdcA-5wxiA:
undetectable
2xdcB-5wxiA:
undetectable		 2xdcA-5wxiA:
undetectable
2xdcB-5wxiA:
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.
5xzu BETA-XYLANASE

(Bispora sp.
MEY-1) 		no annotation 3 TRP A 297
VAL A 252
TRP A 289
 CBI  A 404 (-4.2A)
None
CBI  A 404 (-4.0A)
 1.42A 2xdcA-5xzuA:
undetectable
2xdcB-5xzuA:
undetectable		 2xdcA-5xzuA:
undetectable
2xdcB-5xzuA:
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.
6c9m N-ALPHA-ACETYLTRANSF
ERASE 15, NATA
AUXILIARY SUBUNIT

(Homo sapiens) 		no annotation 3 TRP A  83
VAL A  81
TRP A 109
 None
 0.97A 2xdcA-6c9mA:
undetectable
2xdcB-6c9mA:
undetectable		 2xdcA-6c9mA:
undetectable
2xdcB-6c9mA:
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.
6cxh PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT

(Methylomicrobium
alcaliphilum) 		no annotation 3 TRP B  80
VAL B  75
TRP B  81
 None
 1.18A 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
undetectable		 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
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.
6cxh PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT

(Methylomicrobium
alcaliphilum) 		no annotation 3 TRP B  81
VAL B  75
TRP B  80
 None
 1.04A 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
undetectable		 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
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.
6cxh PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT
PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT

(Methylomicrobium
alcaliphilum;
Methylomicrobium
alcaliphilum) 		no annotation
no annotation 		3 TRP B  87
VAL A 200
TRP A 202
 None
CM5  A 502 ( 4.9A)
None
 1.34A 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
undetectable		 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
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.
6cxh PARTICULATE METHANE
MONOOXYGENASE, B
SUBUNIT
PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT

(Methylomicrobium
alcaliphilum;
Methylomicrobium
alcaliphilum) 		no annotation
no annotation 		3 TRP B  87
VAL A 200
TRP A 206
 None
CM5  A 502 ( 4.9A)
None
 1.22A 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
undetectable		 2xdcA-6cxhB:
undetectable
2xdcB-6cxhB:
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.
6f0k ACTF

(Rhodothermus
marinus) 		no annotation 3 TRP F 361
VAL F 319
TRP F 313
 None
 1.34A 2xdcA-6f0kF:
undetectable
2xdcB-6f0kF:
undetectable		 2xdcA-6f0kF:
undetectable
2xdcB-6f0kF:
undetectable