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- Structure Biounit | Ligand Information
- PDB : .ZIP | .CSV
- Family 90% : .ZIP | .CSV
- Class : .ZIP | .CSV
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 29 families. | |||||
1 | 4IZC | - | 1GZ | C25 H40 N7 O17 P3 S2 | CC(C)(COP(.... |
2 | 4IZD | - | 1HE | C25 H42 N7 O17 P3 S2 | CC(C)(COP(.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 21 families. | |||||
1 | 4IZC | - | 1GZ | C25 H40 N7 O17 P3 S2 | CC(C)(COP(.... |
2 | 4IZD | - | 1HE | C25 H42 N7 O17 P3 S2 | CC(C)(COP(.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | 1GZ | 1 | 1 |
2 | COO | 0.890625 | 0.988636 |
3 | ACO | 0.850394 | 0.955556 |
4 | CO6 | 0.838462 | 0.966292 |
5 | 3KK | 0.837209 | 0.966292 |
6 | CAO | 0.834646 | 0.934066 |
7 | COS | 0.834646 | 0.944444 |
8 | WCA | 0.832117 | 0.966667 |
9 | OXK | 0.830769 | 0.966292 |
10 | YXR | 0.827068 | 0.877551 |
11 | YXS | 0.827068 | 0.877551 |
12 | 3HC | 0.825758 | 0.977273 |
13 | 1HE | 0.825758 | 0.966667 |
14 | 1VU | 0.824427 | 0.955556 |
15 | FYN | 0.823077 | 0.965909 |
16 | 8Z2 | 0.821429 | 0.956044 |
17 | MCA | 0.819549 | 0.955556 |
18 | 2MC | 0.818182 | 0.945652 |
19 | DAK | 0.814286 | 0.977778 |
20 | BCO | 0.81203 | 0.966292 |
21 | IVC | 0.81203 | 0.977273 |
22 | MLC | 0.81203 | 0.966292 |
23 | IRC | 0.807407 | 0.977273 |
24 | CAA | 0.80597 | 0.977273 |
25 | COK | 0.80303 | 0.944444 |
26 | SOP | 0.80303 | 0.944444 |
27 | SCA | 0.8 | 0.966292 |
28 | MC4 | 0.8 | 0.935484 |
29 | CMC | 0.796992 | 0.944444 |
30 | COA | 0.796875 | 0.965909 |
31 | 0T1 | 0.796875 | 0.94382 |
32 | DCA | 0.795276 | 0.922222 |
33 | KFV | 0.794118 | 0.886598 |
34 | COW | 0.794118 | 0.955556 |
35 | BYC | 0.794118 | 0.966292 |
36 | HGG | 0.794118 | 0.966292 |
37 | 30N | 0.792308 | 0.885417 |
38 | BCA | 0.788321 | 0.955556 |
39 | FAQ | 0.788321 | 0.966292 |
40 | A1S | 0.785185 | 0.944444 |
41 | 1CZ | 0.784173 | 0.955556 |
42 | GRA | 0.782609 | 0.966292 |
43 | HXC | 0.782609 | 0.945055 |
44 | ETB | 0.78125 | 0.911111 |
45 | 3CP | 0.781022 | 0.944444 |
46 | AMX | 0.778626 | 0.954545 |
47 | TGC | 0.776978 | 0.955556 |
48 | 4CA | 0.775362 | 0.934066 |
49 | HAX | 0.774436 | 0.923077 |
50 | 2CP | 0.773723 | 0.934066 |
51 | CMX | 0.772727 | 0.94382 |
52 | SCO | 0.772727 | 0.94382 |
53 | CO8 | 0.771429 | 0.945055 |
54 | 2NE | 0.771429 | 0.945055 |
55 | COF | 0.768116 | 0.923913 |
56 | 2KQ | 0.768116 | 0.945055 |
57 | FCX | 0.766917 | 0.913043 |
58 | FAM | 0.766917 | 0.923077 |
59 | MFK | 0.765957 | 0.945055 |
60 | UCC | 0.765957 | 0.945055 |
61 | DCC | 0.765957 | 0.945055 |
62 | 5F9 | 0.765957 | 0.945055 |
63 | MYA | 0.765957 | 0.945055 |
64 | ST9 | 0.765957 | 0.945055 |
65 | YZS | 0.762963 | 0.877551 |
66 | KGP | 0.762963 | 0.877551 |
67 | MRS | 0.756944 | 0.945055 |
68 | MRR | 0.756944 | 0.945055 |
69 | CS8 | 0.755245 | 0.934783 |
70 | SCD | 0.751825 | 0.94382 |
71 | CA6 | 0.75 | 0.877551 |
72 | HDC | 0.75 | 0.945055 |
73 | 4KX | 0.75 | 0.956044 |
74 | MCD | 0.75 | 0.923077 |
75 | CIC | 0.746479 | 0.944444 |
76 | NMX | 0.744526 | 0.875 |
77 | 4CO | 0.741259 | 0.934066 |
78 | 0FQ | 0.741259 | 0.944444 |
79 | SO5 | 0.741007 | 0.868687 |
80 | CO7 | 0.741007 | 0.988636 |
81 | LCV | 0.741007 | 0.868687 |
82 | YNC | 0.739726 | 0.977528 |
83 | J5H | 0.739726 | 0.966292 |
84 | CAJ | 0.73913 | 0.923077 |
85 | 0ET | 0.736111 | 0.923913 |
86 | 01A | 0.736111 | 0.904255 |
87 | KGJ | 0.733813 | 0.865979 |
88 | 1CV | 0.731034 | 0.966292 |
89 | YE1 | 0.728571 | 0.933333 |
90 | NHM | 0.726027 | 0.923913 |
91 | UOQ | 0.726027 | 0.923913 |
92 | NHW | 0.726027 | 0.923913 |
93 | HFQ | 0.721088 | 0.923913 |
94 | KGA | 0.71831 | 0.857143 |
95 | CA8 | 0.71831 | 0.877551 |
96 | 1HA | 0.715232 | 0.945055 |
97 | F8G | 0.705882 | 0.925532 |
98 | NHQ | 0.701987 | 0.955056 |
99 | CCQ | 0.69863 | 0.945652 |
100 | S0N | 0.69863 | 0.923077 |
101 | 7L1 | 0.695652 | 0.955556 |
102 | UCA | 0.691824 | 0.945055 |
103 | 01K | 0.688312 | 0.944444 |
104 | COT | 0.683871 | 0.944444 |
105 | CA3 | 0.675159 | 0.944444 |
106 | N9V | 0.66443 | 0.934066 |
107 | CA5 | 0.654321 | 0.904255 |
108 | RMW | 0.654321 | 0.966667 |
109 | 93P | 0.650307 | 0.934066 |
110 | COD | 0.647059 | 0.954545 |
111 | 93M | 0.630952 | 0.934066 |
112 | 4BN | 0.622857 | 0.925532 |
113 | 5TW | 0.622857 | 0.925532 |
114 | JBT | 0.614525 | 0.886598 |
115 | BUA COA | 0.613333 | 0.933333 |
116 | OXT | 0.602273 | 0.905263 |
117 | BSJ | 0.6 | 0.913979 |
118 | HMG | 0.6 | 0.933333 |
119 | 6NA COA | 0.593548 | 0.913043 |
120 | COA FLC | 0.593103 | 0.932584 |
121 | DAO COA | 0.582278 | 0.913043 |
122 | DCR COA | 0.582278 | 0.913043 |
123 | EO3 COA | 0.582278 | 0.913043 |
124 | DKA COA | 0.582278 | 0.913043 |
125 | X90 COA | 0.582278 | 0.913043 |
126 | PLM COA | 0.582278 | 0.913043 |
127 | MYR COA | 0.582278 | 0.913043 |
128 | PAP | 0.536 | 0.784091 |
129 | ASP ASP ASP ILE NH2 CMC | 0.528736 | 0.902174 |
130 | SFC | 0.511905 | 0.945055 |
131 | RFC | 0.511905 | 0.945055 |
132 | PPS | 0.5 | 0.729167 |
133 | A3P | 0.488 | 0.772727 |
134 | MET VAL ASN ALA CMC | 0.484043 | 0.923077 |
135 | 5AD NJS | 0.480226 | 0.924731 |
136 | ACE SER ASP ALY THR NH2 COA | 0.478947 | 0.902174 |
137 | 0WD | 0.473684 | 0.782609 |
138 | ACE MET LEU GLY PRO NH2 COA | 0.452736 | 0.923077 |
139 | PTJ | 0.443662 | 0.842697 |
140 | HQG | 0.434783 | 0.786517 |
141 | PUA | 0.43125 | 0.813187 |
142 | 3AM | 0.428571 | 0.761364 |
143 | PAJ | 0.425532 | 0.853933 |
144 | A22 | 0.421429 | 0.786517 |
145 | MDE | 0.415789 | 0.945652 |
146 | ADQ | 0.415493 | 0.777778 |
147 | A2D | 0.415385 | 0.775281 |
148 | 3OD | 0.413793 | 0.797753 |
149 | UBG | 0.412429 | 0.817204 |
150 | ATR | 0.411765 | 0.772727 |
151 | AGS | 0.411765 | 0.8 |
152 | 9BG | 0.411392 | 0.763441 |
153 | ADP | 0.406015 | 0.795455 |
154 | 48N | 0.405229 | 0.782609 |
155 | A2R | 0.404255 | 0.786517 |
156 | 8LE | 0.402878 | 0.820225 |
157 | JNT | 0.402778 | 0.818182 |
158 | OAD | 0.4 | 0.797753 |
159 | NA7 | 0.4 | 0.829545 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 4izc.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 4izc.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 4izc.bio1) has 33 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 4izc.bio1) has 25 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 5) in the query (biounit: 4izc.bio1) has 25 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 6) in the query (biounit: 4izc.bio1) has 25 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |