POTENTIAL TARGETS FROM HUMAN (RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES)
1) User may click on the DrReposER ID (the second column) to get information on the binding sites and drug molecule.
2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).
3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera through AutoDock Vina.


DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD 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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
2daq WHSC1L1 PROTEIN,
ISOFORM LONG
(Homo
sapiens)
4 / 4ILE A  29
GLN A  13
VAL A  15
PHE A  49
None
1.10A16.54
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
2l4m UNCHARACTERIZED
PROTEIN
(Homo
sapiens)
4 / 4ILE A 128
GLN A 123
VAL A 127
PHE A 116
None
1.50A13.51
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
2q6z UROPORPHYRINOGEN
DECARBOXYLASE
(Homo
sapiens)
4 / 4ILE A 334
GLN A 302
VAL A 279
PHE A  19
None
1.13A21.88
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
3fnv CDGSH IRON SULFUR
DOMAIN-CONTAINING
PROTEIN 2
(Homo
sapiens)
4 / 4ILE A  75
GLN A  76
VAL A  82
PHE A 107
None
1.27A15.89
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
3l43 DYNAMIN-3
(Homo
sapiens)
4 / 4ILE A 135
GLN A  33
VAL A  70
PHE A 163
None
1.26A21.21
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
3qci RECEPTOR-TYPE
TYROSINE-PROTEIN
PHOSPHATASE GAMMA
(Homo
sapiens)
4 / 4ILE A1095
GLN A1098
VAL A 912
PHE A1091
None
1.48A21.96
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
4fww MACROPHAGE-STIMULATI
NG PROTEIN RECEPTOR
(Homo
sapiens)
4 / 4ILE A 471
GLN A 473
VAL A 520
PHE A 511
None
1.45A19.16
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
4gs4 ALPHA-TUBULIN
N-ACETYLTRANSFERASE
(Homo
sapiens)
4 / 4ILE A 185
GLN A 179
VAL A 106
PHE A 190
None
1.44A21.83
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
4ooa CDGSH IRON-SULFUR
DOMAIN-CONTAINING
PROTEIN 2
(Homo
sapiens)
4 / 4ILE A  75
GLN A  76
VAL A  82
PHE A 107
None
1.29A13.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
4qk3 CARBONIC ANHYDRASE 2
(Homo
sapiens)
4 / 4ILE A  91
GLN A  92
VAL A 121
PHE A 131
None
0.23A95.77
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.
3IEO_A_AMJA300_0
(CARBONIC ANHYDRASE 2)
5fhz ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3
(Homo
sapiens)
4 / 4ILE A 419
GLN A 417
VAL A 320
PHE A 330
None
1.13A20.42