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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 9 families. | |||||
1 | 2JC9 | - | ADN | C10 H13 N5 O4 | c1nc(c2c(n.... |
2 | 2XJF | - | DG2 | C3 H8 O10 P2 | C([C@H](C(.... |
3 | 2XJE | - | U5P | C9 H13 N2 O9 P | C1=CN(C(=O.... |
4 | 2XCV | - | IMP | C10 H13 N4 O8 P | c1nc2c(n1[.... |
5 | 2XJD | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
6 | 6DE2 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
7 | 2XCW | - | IMP | C10 H13 N4 O8 P | c1nc2c(n1[.... |
8 | 2XJC | - | B4P | C20 H28 N10 O19 P4 | c1nc(c2c(n.... |
9 | 6DDZ | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
10 | 2XJB | - | DTP | C10 H16 N5 O12 P3 | c1nc(c2c(n.... |
11 | 5OPK | - | DTP | C10 H16 N5 O12 P3 | c1nc(c2c(n.... |
12 | 5OPM | - | DTP | C10 H16 N5 O12 P3 | c1nc(c2c(n.... |
No: | PDB id | Binding Data | Representative ligand | Formula | Smiles |
---|---|---|---|---|---|
The Class containing this family consists of a total of 8 families. | |||||
1 | 2JC9 | - | ADN | C10 H13 N5 O4 | c1nc(c2c(n.... |
2 | 2XJF | - | DG2 | C3 H8 O10 P2 | C([C@H](C(.... |
3 | 2XJE | - | U5P | C9 H13 N2 O9 P | C1=CN(C(=O.... |
4 | 2XCV | - | IMP | C10 H13 N4 O8 P | c1nc2c(n1[.... |
5 | 2XJD | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
6 | 6DE2 | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
7 | 2XCW | - | IMP | C10 H13 N4 O8 P | c1nc2c(n1[.... |
8 | 2XJC | - | B4P | C20 H28 N10 O19 P4 | c1nc(c2c(n.... |
9 | 6DDZ | - | ATP | C10 H16 N5 O13 P3 | c1nc(c2c(n.... |
10 | 2XJB | - | DTP | C10 H16 N5 O12 P3 | c1nc(c2c(n.... |
11 | 5OPK | - | DTP | C10 H16 N5 O12 P3 | c1nc(c2c(n.... |
12 | 5OPM | - | DTP | C10 H16 N5 O12 P3 | c1nc(c2c(n.... |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | G | 1 | 1 |
2 | 5GP | 1 | 1 |
3 | GDP | 0.828947 | 0.986486 |
4 | GP3 | 0.815789 | 0.960526 |
5 | GP2 | 0.805195 | 0.948052 |
6 | GTP | 0.797468 | 0.986486 |
7 | GNH | 0.794872 | 0.973333 |
8 | G2P | 0.777778 | 0.948052 |
9 | GMV | 0.775 | 0.960526 |
10 | GCP | 0.765432 | 0.960526 |
11 | G1R | 0.765432 | 0.973333 |
12 | GAV | 0.759036 | 0.948052 |
13 | GSP | 0.756098 | 0.935897 |
14 | GNP | 0.756098 | 0.960526 |
15 | 9GM | 0.756098 | 0.960526 |
16 | ALF 5GP | 0.753086 | 0.9 |
17 | GDP BEF | 0.743902 | 0.947368 |
18 | GTP MG | 0.73494 | 0.972973 |
19 | GMP | 0.732394 | 0.866667 |
20 | GPG | 0.724138 | 0.948052 |
21 | G2R | 0.712644 | 0.948052 |
22 | GDP ALF | 0.701149 | 0.9 |
23 | GDP AF3 | 0.701149 | 0.9 |
24 | GKE | 0.692308 | 0.948052 |
25 | GDC | 0.692308 | 0.948052 |
26 | Y9Z | 0.692308 | 0.890244 |
27 | GDD | 0.692308 | 0.948052 |
28 | YGP | 0.681319 | 0.9125 |
29 | G3A | 0.677419 | 0.960526 |
30 | G5P | 0.670213 | 0.960526 |
31 | KB7 | 0.666667 | 0.8375 |
32 | GFB | 0.666667 | 0.948052 |
33 | GDR | 0.666667 | 0.948052 |
34 | GTG | 0.666667 | 0.924051 |
35 | 6CK | 0.659574 | 0.924051 |
36 | 3GP | 0.65 | 0.959459 |
37 | JB2 | 0.645833 | 0.948052 |
38 | GKD | 0.645833 | 0.948052 |
39 | GDX | 0.639175 | 0.960526 |
40 | GPD | 0.639175 | 0.9125 |
41 | GDP 7MG | 0.635417 | 0.923077 |
42 | G3D | 0.617977 | 0.972973 |
43 | U2G | 0.617647 | 0.924051 |
44 | KBD | 0.612903 | 0.8375 |
45 | 2GP | 0.609756 | 0.946667 |
46 | IMP | 0.609756 | 0.972603 |
47 | JB3 | 0.607843 | 0.935897 |
48 | CG2 | 0.605769 | 0.924051 |
49 | G4P | 0.604396 | 0.972973 |
50 | DG | 0.60241 | 0.922078 |
51 | DGP | 0.60241 | 0.922078 |
52 | NGD | 0.601942 | 0.948052 |
53 | FEG | 0.601942 | 0.890244 |
54 | ZGP | 0.596154 | 0.879518 |
55 | 0O2 | 0.595745 | 0.972973 |
56 | KBJ | 0.587629 | 0.807229 |
57 | 2MD | 0.584906 | 0.879518 |
58 | G7M | 0.583333 | 0.960526 |
59 | CAG | 0.583333 | 0.869048 |
60 | MGD | 0.568807 | 0.879518 |
61 | DBG | 0.566372 | 0.935897 |
62 | MD1 | 0.5625 | 0.879518 |
63 | PGD | 0.5625 | 0.9125 |
64 | P2G | 0.55814 | 0.894737 |
65 | FE9 | 0.553571 | 0.784946 |
66 | P1G | 0.545455 | 0.883117 |
67 | GH3 | 0.542553 | 0.96 |
68 | I2C FE2 CMO CMO | 0.539823 | 0.818182 |
69 | TPG | 0.53913 | 0.829545 |
70 | GPX | 0.53125 | 0.933333 |
71 | DGI | 0.527473 | 0.910256 |
72 | G1R G1R | 0.525862 | 0.911392 |
73 | PGD O | 0.521368 | 0.83908 |
74 | DGT | 0.521277 | 0.910256 |
75 | G4M | 0.520325 | 0.869048 |
76 | AKW | 0.513761 | 0.878049 |
77 | G C | 0.513514 | 0.911392 |
78 | 93A | 0.511364 | 0.821429 |
79 | IDP | 0.505495 | 0.959459 |
80 | MGQ | 0.505155 | 0.948052 |
81 | C2R | 0.5 | 0.893333 |
82 | A | 0.5 | 0.905405 |
83 | BGO | 0.5 | 0.911392 |
84 | AMZ | 0.5 | 0.905405 |
85 | AMP | 0.5 | 0.905405 |
86 | AIR | 0.493671 | 0.890411 |
87 | MGV | 0.49 | 0.901235 |
88 | QBQ | 0.489362 | 0.972973 |
89 | SGP | 0.488889 | 0.8375 |
90 | NIA | 0.488095 | 0.8375 |
91 | GPC | 0.474138 | 0.890244 |
92 | GGM | 0.473684 | 0.888889 |
93 | 71V | 0.47191 | 0.85 |
94 | R5I | 0.46875 | 0.933333 |
95 | MGP | 0.46875 | 0.948052 |
96 | R7I | 0.46875 | 0.933333 |
97 | C2E | 0.468085 | 0.933333 |
98 | PCG | 0.468085 | 0.945946 |
99 | 35G | 0.468085 | 0.945946 |
100 | G1G | 0.466102 | 0.9125 |
101 | 7RA | 0.465909 | 0.918919 |
102 | FAI | 0.465909 | 0.905405 |
103 | AAM | 0.465909 | 0.905405 |
104 | RMB | 0.465909 | 0.813333 |
105 | 1RB | 0.465116 | 0.824324 |
106 | 6G0 | 0.463918 | 0.948052 |
107 | 5GP 5GP | 0.463158 | 0.894737 |
108 | RBZ | 0.45977 | 0.815789 |
109 | UCG | 0.459016 | 0.923077 |
110 | APC G U | 0.458333 | 0.897436 |
111 | IMO | 0.449438 | 0.866667 |
112 | 6MZ | 0.444444 | 0.868421 |
113 | IRN | 0.443038 | 0.808219 |
114 | PMO | 0.43956 | 0.792208 |
115 | 7RP | 0.438202 | 0.864865 |
116 | NYZ | 0.4375 | 0.923077 |
117 | GTA | 0.436364 | 0.924051 |
118 | JLN | 0.433333 | 0.88 |
119 | P2P | 0.433333 | 0.842105 |
120 | CZF | 0.43299 | 0.92 |
121 | XMP | 0.428571 | 0.907895 |
122 | M7G A2M G | 0.427586 | 0.818182 |
123 | PGS | 0.425532 | 0.804878 |
124 | RVP | 0.423529 | 0.84 |
125 | G2Q | 0.423077 | 0.948052 |
126 | ADP | 0.419355 | 0.906667 |
127 | ABM | 0.417582 | 0.857143 |
128 | 45A | 0.417582 | 0.857143 |
129 | A2D | 0.417582 | 0.881579 |
130 | PRT | 0.416667 | 0.945946 |
131 | GUO | 0.415842 | 0.932432 |
132 | AT4 | 0.414894 | 0.871795 |
133 | AMP MG | 0.411111 | 0.866667 |
134 | CA0 | 0.410526 | 0.883117 |
135 | 2SA | 0.41 | 0.871795 |
136 | OK8 | 0.41 | 0.87013 |
137 | 1YD | 0.409091 | 0.933333 |
138 | 4BW | 0.409091 | 0.933333 |
139 | BA3 | 0.408602 | 0.881579 |
140 | AP2 | 0.408602 | 0.871795 |
141 | A12 | 0.408602 | 0.871795 |
142 | 6C6 | 0.408163 | 0.825 |
143 | 25A | 0.407767 | 0.906667 |
144 | NOS | 0.406977 | 0.813333 |
145 | ATP | 0.40625 | 0.906667 |
146 | KG4 | 0.40625 | 0.883117 |
147 | HEJ | 0.40625 | 0.906667 |
148 | B4P | 0.404255 | 0.881579 |
149 | AP5 | 0.404255 | 0.881579 |
150 | 6IA | 0.40404 | 0.785714 |
151 | ACQ | 0.40404 | 0.883117 |
152 | ANP | 0.40404 | 0.883117 |
153 | CGP | 0.403361 | 0.878049 |
154 | 3ZE | 0.402062 | 0.871795 |
155 | 5FA | 0.402062 | 0.906667 |
156 | APC | 0.402062 | 0.871795 |
157 | AQP | 0.402062 | 0.906667 |
158 | AN2 | 0.4 | 0.894737 |
159 | N6P | 0.4 | 0.853333 |
No: | Ligand | ECFP6 Tc | MDL keys Tc |
---|---|---|---|
1 | B4P | 1 | 1 |
2 | AP5 | 1 | 1 |
3 | BA3 | 0.984615 | 1 |
4 | AQP | 0.942029 | 0.971831 |
5 | 5FA | 0.942029 | 0.971831 |
6 | ATP | 0.927536 | 0.971831 |
7 | HEJ | 0.927536 | 0.971831 |
8 | A2D | 0.924242 | 1 |
9 | ADP | 0.884058 | 0.971831 |
10 | AGS | 0.875 | 0.92 |
11 | AT4 | 0.84507 | 0.932432 |
12 | AN2 | 0.84507 | 0.958333 |
13 | APR | 0.835616 | 0.971831 |
14 | AR6 | 0.835616 | 0.971831 |
15 | M33 | 0.833333 | 0.958333 |
16 | AD9 | 0.824324 | 0.945205 |
17 | ACP | 0.821918 | 0.945205 |
18 | ACQ | 0.802632 | 0.945205 |
19 | ANP | 0.802632 | 0.945205 |
20 | A | 0.797101 | 0.943662 |
21 | AMP | 0.797101 | 0.943662 |
22 | 6YZ | 0.794872 | 0.945205 |
23 | ADX | 0.783784 | 0.873418 |
24 | CA0 | 0.783784 | 0.945205 |
25 | KG4 | 0.773333 | 0.945205 |
26 | 50T | 0.773333 | 0.931507 |
27 | 45A | 0.763889 | 0.917808 |
28 | ABM | 0.763889 | 0.917808 |
29 | PRX | 0.763158 | 0.893333 |
30 | HQG | 0.7625 | 0.958333 |
31 | AMP MG | 0.760563 | 0.929577 |
32 | ATF | 0.759494 | 0.932432 |
33 | T99 | 0.75641 | 0.932432 |
34 | TAT | 0.75641 | 0.932432 |
35 | A22 | 0.753086 | 0.985915 |
36 | 25L | 0.752941 | 0.985915 |
37 | AP2 | 0.743243 | 0.932432 |
38 | A12 | 0.743243 | 0.932432 |
39 | APC | 0.74026 | 0.932432 |
40 | SRA | 0.736111 | 0.893333 |
41 | A3R | 0.73494 | 0.907895 |
42 | ADQ | 0.73494 | 0.972222 |
43 | A1R | 0.73494 | 0.907895 |
44 | JNT | 0.72619 | 0.945205 |
45 | 8LE | 0.725 | 0.894737 |
46 | 5AL | 0.725 | 0.931507 |
47 | ADP BEF | 0.723684 | 0.943662 |
48 | ADP MG | 0.723684 | 0.943662 |
49 | G5P | 0.722222 | 0.921053 |
50 | 9X8 | 0.717647 | 0.92 |
51 | OAD | 0.717647 | 0.945205 |
52 | AU1 | 0.714286 | 0.945205 |
53 | G3A | 0.711111 | 0.921053 |
54 | APC MG | 0.708861 | 0.917808 |
55 | SRP | 0.707317 | 0.906667 |
56 | 8LH | 0.707317 | 0.906667 |
57 | 8QN | 0.702381 | 0.931507 |
58 | 3OD | 0.701149 | 0.945205 |
59 | GTA | 0.695652 | 0.886076 |
60 | 4AD | 0.694118 | 0.92 |
61 | UP5 | 0.691489 | 0.945946 |
62 | QA7 | 0.690476 | 0.894737 |
63 | 8LQ | 0.690476 | 0.906667 |
64 | ATP MG | 0.6875 | 0.943662 |
65 | RBY | 0.6875 | 0.932432 |
66 | ADP PO3 | 0.6875 | 0.943662 |
67 | ADV | 0.6875 | 0.932432 |
68 | 00A | 0.686047 | 0.907895 |
69 | OOB | 0.682353 | 0.958333 |
70 | 25A | 0.682353 | 0.971831 |
71 | 5SV | 0.682353 | 0.848101 |
72 | OZV | 0.682353 | 0.971831 |
73 | BIS | 0.681818 | 0.907895 |
74 | BEF ADP | 0.679012 | 0.917808 |
75 | KMQ | 0.677778 | 0.932432 |
76 | VO4 ADP | 0.674699 | 0.918919 |
77 | PAJ | 0.674419 | 0.884615 |
78 | AMO | 0.674419 | 0.932432 |
79 | 7D4 | 0.670886 | 0.88 |
80 | ITT | 0.670886 | 0.916667 |
81 | MAP | 0.670588 | 0.92 |
82 | A4P | 0.670103 | 0.843373 |
83 | DLL | 0.666667 | 0.958333 |
84 | AHX | 0.666667 | 0.896104 |
85 | V2G | 0.662651 | 0.871795 |
86 | 3UK | 0.659091 | 0.945205 |
87 | SON | 0.658228 | 0.906667 |
88 | T5A | 0.656566 | 0.864198 |
89 | ANP MG | 0.654762 | 0.931507 |
90 | ALF ADP | 0.654762 | 0.87013 |
91 | LMS | 0.653333 | 0.82716 |
92 | PR8 | 0.651685 | 0.85 |
93 | B5V | 0.651685 | 0.932432 |
94 | WAQ | 0.651685 | 0.883117 |
95 | LAD | 0.651685 | 0.860759 |
96 | GAP | 0.650602 | 0.893333 |
97 | AFH | 0.648936 | 0.909091 |
98 | TXA | 0.644444 | 0.932432 |
99 | NB8 | 0.644444 | 0.896104 |
100 | 1ZZ | 0.644444 | 0.839506 |
101 | FYA | 0.644444 | 0.931507 |
102 | PTJ | 0.644444 | 0.871795 |
103 | ME8 | 0.644444 | 0.839506 |
104 | DQV | 0.642105 | 0.985915 |
105 | JSQ | 0.638554 | 0.92 |
106 | HFD | 0.638554 | 0.92 |
107 | 2A5 | 0.634146 | 0.893333 |
108 | DAL AMP | 0.632184 | 0.905405 |
109 | 9SN | 0.630435 | 0.896104 |
110 | 48N | 0.628866 | 0.896104 |
111 | PAP | 0.626506 | 0.957747 |
112 | ATR | 0.626506 | 0.943662 |
113 | 9ZA | 0.625 | 0.883117 |
114 | 9ZD | 0.625 | 0.883117 |
115 | B5M | 0.623656 | 0.92 |
116 | B5Y | 0.623656 | 0.92 |
117 | FA5 | 0.623656 | 0.932432 |
118 | RAB | 0.623188 | 0.84507 |
119 | XYA | 0.623188 | 0.84507 |
120 | ADN | 0.623188 | 0.84507 |
121 | 6V0 | 0.622449 | 0.921053 |
122 | DND | 0.622449 | 0.958904 |
123 | NAI | 0.622449 | 0.933333 |
124 | NAX | 0.622449 | 0.897436 |
125 | TXD | 0.622449 | 0.933333 |
126 | 7D3 | 0.620253 | 0.88 |
127 | XAH | 0.617021 | 0.839506 |
128 | TXE | 0.616162 | 0.933333 |
129 | OMR | 0.616162 | 0.851852 |
130 | AOC | 0.615385 | 0.821918 |
131 | 4UV | 0.610526 | 0.92 |
132 | AP0 | 0.61 | 0.921053 |
133 | L3W | 0.61 | 0.932432 |
134 | 5N5 | 0.605634 | 0.819444 |
135 | 5AS | 0.604938 | 0.77907 |
136 | ADP BMA | 0.604396 | 0.945205 |
137 | A2R | 0.602273 | 0.958333 |
138 | CNA | 0.601942 | 0.958904 |
139 | 4UU | 0.597938 | 0.92 |
140 | GA7 | 0.597938 | 0.932432 |
141 | 5CD | 0.597222 | 0.805556 |
142 | A4D | 0.597222 | 0.819444 |
143 | 4TC | 0.594059 | 0.921053 |
144 | 3AT | 0.593023 | 0.944444 |
145 | 139 | 0.592233 | 0.897436 |
146 | ADJ | 0.592233 | 0.875 |
147 | LAQ | 0.585859 | 0.839506 |
148 | F2R | 0.580952 | 0.841463 |
149 | YLP | 0.58 | 0.819277 |
150 | COD | 0.575472 | 0.811765 |
151 | DTP | 0.574713 | 0.88 |
152 | JB6 | 0.574468 | 0.907895 |
153 | 4UW | 0.574257 | 0.884615 |
154 | EP4 | 0.573333 | 0.753247 |
155 | A3P | 0.573171 | 0.943662 |
156 | ATP A A A | 0.572917 | 0.957747 |
157 | ATP A | 0.572917 | 0.957747 |
158 | 7D5 | 0.571429 | 0.853333 |
159 | TYM | 0.568627 | 0.932432 |
160 | MYR AMP | 0.568421 | 0.817073 |
161 | 6AD | 0.568182 | 0.884615 |
162 | DTA | 0.565789 | 0.810811 |
163 | M2T | 0.565789 | 0.734177 |
164 | 80F | 0.564815 | 0.864198 |
165 | H1Q | 0.564706 | 0.90411 |
166 | 3DH | 0.564103 | 0.773333 |
167 | G5A | 0.563218 | 0.77907 |
168 | UPA | 0.563107 | 0.933333 |
169 | YLC | 0.563107 | 0.839506 |
170 | YLB | 0.563107 | 0.819277 |
171 | NAD | 0.560748 | 0.958333 |
172 | TSB | 0.56044 | 0.819277 |
173 | MTA | 0.558442 | 0.773333 |
174 | 3AM | 0.556962 | 0.902778 |
175 | SSA | 0.555556 | 0.8 |
176 | AHZ | 0.554455 | 0.817073 |
177 | A2P | 0.554217 | 0.929577 |
178 | NA7 | 0.553191 | 0.932432 |
179 | IOT | 0.552381 | 0.809524 |
180 | PPS | 0.550562 | 0.85 |
181 | A3D | 0.550459 | 0.945205 |
182 | 7MD | 0.55 | 0.8625 |
183 | ARG AMP | 0.55 | 0.807229 |
184 | AR6 AR6 | 0.55 | 0.944444 |
185 | NO7 | 0.549451 | 0.906667 |
186 | 54H | 0.549451 | 0.788235 |
187 | VMS | 0.549451 | 0.788235 |
188 | YLA | 0.54717 | 0.819277 |
189 | CUU | 0.546512 | 0.944444 |
190 | AMP DBH | 0.545455 | 0.918919 |
191 | TAD | 0.544554 | 0.884615 |
192 | AV2 | 0.544444 | 0.891892 |
193 | A5A | 0.544444 | 0.807229 |
194 | 6RE | 0.54321 | 0.7375 |
195 | AYB | 0.542056 | 0.809524 |
196 | 7DT | 0.54023 | 0.957747 |
197 | DDS | 0.539326 | 0.853333 |
198 | AVV | 0.537634 | 0.896104 |
199 | 52H | 0.532609 | 0.77907 |
200 | BTX | 0.53211 | 0.819277 |
201 | NSS | 0.531915 | 0.8 |
202 | NAE | 0.530973 | 0.92 |
203 | ZAS | 0.530864 | 0.766234 |
204 | A3N | 0.53012 | 0.786667 |
205 | IMO | 0.53012 | 0.902778 |
206 | J7C | 0.53012 | 0.746835 |
207 | DAT | 0.528736 | 0.88 |
208 | BT5 | 0.527273 | 0.809524 |
209 | 53H | 0.526882 | 0.77907 |
210 | 5CA | 0.526882 | 0.8 |
211 | 8X1 | 0.526882 | 0.752809 |
212 | NVA LMS | 0.526316 | 0.752809 |
213 | NAQ | 0.526316 | 0.896104 |
214 | ARU | 0.526316 | 0.8375 |
215 | EAD | 0.525862 | 0.897436 |
216 | 9K8 | 0.525773 | 0.733333 |
217 | RGT | 0.525253 | 0.932432 |
218 | 2AM | 0.525 | 0.916667 |
219 | AF3 ADP 3PG | 0.52381 | 0.8375 |
220 | ALF ADP 3PG | 0.52381 | 0.8375 |
221 | 6MZ | 0.52381 | 0.90411 |
222 | S4M | 0.52381 | 0.666667 |
223 | V3L | 0.522222 | 0.944444 |
224 | ZID | 0.521739 | 0.945205 |
225 | LEU LMS | 0.520833 | 0.730337 |
226 | LPA AMP | 0.519231 | 0.817073 |
227 | NAD IBO | 0.518868 | 0.944444 |
228 | 7MC | 0.518868 | 0.841463 |
229 | NAD TDB | 0.518868 | 0.944444 |
230 | DSH | 0.518072 | 0.725 |
231 | MAO | 0.517647 | 0.759036 |
232 | D4F | 0.517544 | 0.8625 |
233 | LSS | 0.515789 | 0.761364 |
234 | DSZ | 0.515789 | 0.8 |
235 | P5A | 0.515464 | 0.744444 |
236 | DZD | 0.513514 | 0.909091 |
237 | NWW | 0.513158 | 0.760563 |
238 | FB0 | 0.512397 | 0.784091 |
239 | 5X8 | 0.511364 | 0.763158 |
240 | O02 | 0.511111 | 0.896104 |
241 | GP3 | 0.511111 | 0.921053 |
242 | YLY | 0.508772 | 0.809524 |
243 | M24 | 0.508772 | 0.873418 |
244 | 38V | 0.508621 | 0.886076 |
245 | N0B | 0.508621 | 0.841463 |
246 | P1H | 0.508333 | 0.875 |
247 | 5AD | 0.506849 | 0.746479 |
248 | OVE | 0.506024 | 0.88 |
249 | GJV | 0.505882 | 0.728395 |
250 | 7DD | 0.505747 | 0.957747 |
251 | NAJ PZO | 0.504425 | 0.871795 |
252 | NEC | 0.5 | 0.746667 |
253 | GSU | 0.5 | 0.77907 |
254 | 128 | 0.5 | 0.776471 |
255 | KAA | 0.5 | 0.752809 |
256 | NDE | 0.495868 | 0.932432 |
257 | NJP | 0.495495 | 0.945946 |
258 | 6C6 | 0.494505 | 0.857143 |
259 | SFG | 0.494382 | 0.75 |
260 | FDA | 0.491935 | 0.833333 |
261 | AMP NAD | 0.491071 | 0.931507 |
262 | 4TA | 0.491071 | 0.829268 |
263 | 0WD | 0.491071 | 0.921053 |
264 | YSA | 0.490196 | 0.8 |
265 | GTP | 0.489362 | 0.894737 |
266 | A7D | 0.488636 | 0.776316 |
267 | 6FA | 0.488 | 0.864198 |
268 | NDC | 0.487805 | 0.896104 |
269 | NAJ PYZ | 0.487179 | 0.829268 |
270 | SA8 | 0.483516 | 0.707317 |
271 | A5D | 0.483516 | 0.810811 |
272 | MHZ | 0.483146 | 0.697674 |
273 | 71V | 0.482759 | 0.883117 |
274 | A3G | 0.482353 | 0.8 |
275 | ODP | 0.482143 | 0.909091 |
276 | Y3J | 0.480519 | 0.726027 |
277 | K3K | 0.480392 | 0.826667 |
278 | 8PZ | 0.480392 | 0.821429 |
279 | FAS | 0.480315 | 0.875 |
280 | FAD | 0.480315 | 0.875 |
281 | SFD | 0.480315 | 0.752688 |
282 | 7D7 | 0.48 | 0.743243 |
283 | GGZ | 0.479167 | 0.825 |
284 | HDV | 0.478723 | 0.868421 |
285 | SAH | 0.478261 | 0.74359 |
286 | SAI | 0.478261 | 0.734177 |
287 | NDP | 0.477477 | 0.921053 |
288 | NPW | 0.477477 | 0.886076 |
289 | LQJ | 0.475728 | 0.944444 |
290 | B1U | 0.475728 | 0.755556 |
291 | PO4 PO4 A A A A PO4 | 0.474747 | 0.929577 |
292 | SMM | 0.473684 | 0.686047 |
293 | TXP | 0.473214 | 0.921053 |
294 | NZQ | 0.473214 | 0.909091 |
295 | 6IA | 0.473118 | 0.814815 |
296 | SAM | 0.473118 | 0.690476 |
297 | CZF | 0.473118 | 0.905405 |
298 | K3E | 0.471154 | 0.815789 |
299 | J4G | 0.47 | 0.894737 |
300 | NWQ | 0.46988 | 0.739726 |
301 | AAT | 0.468085 | 0.707317 |
302 | QBQ | 0.468085 | 0.881579 |
303 | EEM | 0.468085 | 0.690476 |
304 | PGS | 0.466667 | 0.858974 |
305 | 7C5 | 0.466667 | 0.818182 |
306 | 62F | 0.465649 | 0.886076 |
307 | FNK | 0.465649 | 0.804598 |
308 | D5M | 0.465116 | 0.853333 |
309 | N5O | 0.465116 | 0.763158 |
310 | DA | 0.465116 | 0.853333 |
311 | N6P | 0.464646 | 0.915493 |
312 | GSP | 0.463918 | 0.85 |
313 | 2SA | 0.463158 | 0.906667 |
314 | KOY | 0.462963 | 0.826667 |
315 | FAY | 0.462121 | 0.886076 |
316 | A3T | 0.461538 | 0.821918 |
317 | AAM | 0.45977 | 0.943662 |
318 | QXP | 0.459184 | 0.785714 |
319 | GEK | 0.459184 | 0.7375 |
320 | RFL | 0.458647 | 0.843373 |
321 | S7M | 0.458333 | 0.690476 |
322 | V47 | 0.458333 | 0.808219 |
323 | 6G0 | 0.458333 | 0.860759 |
324 | 4YB | 0.457944 | 0.781609 |
325 | AMZ | 0.457831 | 0.890411 |
326 | C2R | 0.457831 | 0.878378 |
327 | GDP | 0.457447 | 0.894737 |
328 | A3S | 0.455556 | 0.810811 |
329 | WSA | 0.454545 | 0.809524 |
330 | N5A | 0.454545 | 0.736842 |
331 | Z5A | 0.454545 | 0.8 |
332 | 12D | 0.453704 | 0.785714 |
333 | XNP | 0.452174 | 0.873418 |
334 | 8Q2 | 0.45045 | 0.793103 |
335 | AIR | 0.45 | 0.875 |
336 | 62X | 0.45 | 0.666667 |
337 | ETB | 0.449153 | 0.811765 |
338 | DCA | 0.449153 | 0.802326 |
339 | MGP | 0.447917 | 0.860759 |
340 | NIA | 0.447059 | 0.8 |
341 | QXG | 0.445545 | 0.776471 |
342 | K15 | 0.445545 | 0.682353 |
343 | A6D | 0.445545 | 0.743902 |
344 | PUA | 0.445378 | 0.884615 |
345 | 9JJ | 0.445255 | 0.886076 |
346 | 6K6 | 0.444444 | 0.90411 |
347 | V1N | 0.443396 | 0.944444 |
348 | COA | 0.441667 | 0.802326 |
349 | 0T1 | 0.441667 | 0.802326 |
350 | 649 | 0.441441 | 0.764045 |
351 | R2V | 0.441176 | 0.785714 |
352 | 0UM | 0.44 | 0.698795 |
353 | P5F | 0.438849 | 0.823529 |
354 | GCP | 0.438776 | 0.871795 |
355 | G1R | 0.438776 | 0.883117 |
356 | 3AD | 0.4375 | 0.805556 |
357 | DZ4 | 0.4375 | 0.857143 |
358 | GNH | 0.4375 | 0.883117 |
359 | O05 | 0.436893 | 0.843373 |
360 | K2R | 0.436893 | 0.88 |
361 | 101 | 0.436782 | 0.853333 |
362 | NVA 2AD | 0.43617 | 0.759494 |
363 | K2H | 0.435644 | 0.779221 |
364 | NAP | 0.434426 | 0.945205 |
365 | GNP | 0.434343 | 0.871795 |
366 | 9GM | 0.434343 | 0.871795 |
367 | KY2 | 0.434343 | 0.710843 |
368 | K2W | 0.433962 | 0.7625 |
369 | APU | 0.433628 | 0.894737 |
370 | KB1 | 0.432692 | 0.719512 |
371 | F2N | 0.432624 | 0.813953 |
372 | 7RP | 0.431818 | 0.901408 |
373 | CAO | 0.430894 | 0.775281 |
374 | 30N | 0.430894 | 0.734043 |
375 | 1DG | 0.430894 | 0.921053 |
376 | DG1 | 0.430894 | 0.921053 |
377 | TAP | 0.430894 | 0.907895 |
378 | COS | 0.430894 | 0.784091 |
379 | AMX | 0.430894 | 0.811765 |
380 | 2VA | 0.430108 | 0.8 |
381 | S8M | 0.43 | 0.759494 |
382 | GTG | 0.429907 | 0.886076 |
383 | FA9 | 0.429577 | 0.864198 |
384 | K38 | 0.428571 | 0.802632 |
385 | MGO | 0.428571 | 0.8375 |
386 | KL2 | 0.428571 | 0.813333 |
387 | CMX | 0.427419 | 0.802326 |
388 | SCO | 0.427419 | 0.802326 |
389 | NA0 | 0.427419 | 0.932432 |
390 | NHD | 0.42735 | 0.931507 |
391 | K2K | 0.427184 | 0.759494 |
392 | NX8 | 0.427083 | 0.7375 |
393 | 7RA | 0.426966 | 0.930556 |
394 | AS | 0.426966 | 0.810127 |
395 | KYB | 0.425743 | 0.710843 |
396 | ACK | 0.425287 | 0.861111 |
397 | QQY | 0.425287 | 0.815789 |
398 | Q34 | 0.424779 | 0.694118 |
399 | FCX | 0.424 | 0.775281 |
400 | ACO | 0.424 | 0.775281 |
401 | FAM | 0.424 | 0.784091 |
402 | FAJ | 0.423611 | 0.853659 |
403 | OZP | 0.423423 | 0.75 |
404 | CC5 | 0.423077 | 0.816901 |
405 | SXZ | 0.423077 | 0.710843 |
406 | 8BR | 0.422222 | 0.881579 |
407 | EO7 | 0.422222 | 0.788235 |
408 | IDP | 0.421053 | 0.893333 |
409 | ZDA | 0.421053 | 0.84 |
410 | HAX | 0.420635 | 0.784091 |
411 | GDD | 0.420561 | 0.884615 |
412 | K3H | 0.420561 | 0.772152 |
413 | GDC | 0.420561 | 0.884615 |
414 | GKE | 0.420561 | 0.884615 |
415 | KYE | 0.420561 | 0.694118 |
416 | J7V | 0.419355 | 0.833333 |
417 | KY5 | 0.419048 | 0.746835 |
418 | TM1 | 0.419048 | 0.77381 |
419 | 9BG | 0.418803 | 0.896104 |
420 | 2MC | 0.418605 | 0.75 |
421 | KXW | 0.418182 | 0.728395 |
422 | NAD BBN | 0.41791 | 0.864198 |
423 | CMP | 0.417582 | 0.928571 |
424 | 2BA | 0.417582 | 0.942857 |
425 | 3KK | 0.417323 | 0.784091 |
426 | FYN | 0.417323 | 0.802326 |
427 | PLP AAD | 0.416667 | 0.752809 |
428 | SO8 | 0.416667 | 0.789474 |
429 | SLU | 0.416667 | 0.790698 |
430 | 7L1 | 0.416 | 0.775281 |
431 | NMN AMP PO4 | 0.415254 | 0.894737 |
432 | Q2P | 0.415254 | 0.694118 |
433 | 26A | 0.414634 | 0.763158 |
434 | HF7 | 0.414141 | 0.868421 |
435 | KGP | 0.414062 | 0.71134 |
436 | OXK | 0.414062 | 0.784091 |
437 | MCD | 0.414062 | 0.784091 |
438 | SOP | 0.414062 | 0.784091 |
439 | YZS | 0.414062 | 0.71134 |
440 | CA6 | 0.414062 | 0.71134 |
441 | COK | 0.414062 | 0.784091 |
442 | QQX | 0.413793 | 0.805195 |
443 | KY8 | 0.413462 | 0.75 |
444 | G2R | 0.413462 | 0.860759 |
445 | NAD CJ3 | 0.411765 | 0.833333 |
446 | PRT | 0.411215 | 0.905405 |
447 | FAI | 0.411111 | 0.890411 |
448 | RMB | 0.411111 | 0.847222 |
449 | 1VU | 0.410853 | 0.775281 |
450 | CMC | 0.410853 | 0.784091 |
451 | CO6 | 0.410853 | 0.784091 |
452 | NMX | 0.410853 | 0.741935 |
453 | NWZ | 0.410526 | 0.725 |
454 | RP1 | 0.409091 | 0.866667 |
455 | SP1 | 0.409091 | 0.866667 |
456 | SCA | 0.409091 | 0.784091 |
457 | 1RB | 0.409091 | 0.859155 |
458 | ANZ | 0.409091 | 0.8 |
459 | NFD | 0.408333 | 0.907895 |
460 | CAJ | 0.407692 | 0.784091 |
461 | SCD | 0.407692 | 0.802326 |
462 | KGA | 0.406015 | 0.726316 |
463 | D3Y | 0.405941 | 0.813333 |
464 | KH3 | 0.405405 | 0.674419 |
465 | N01 | 0.404959 | 0.931507 |
466 | IVC | 0.40458 | 0.793103 |
467 | 1HE | 0.40458 | 0.766667 |
468 | A1S | 0.40458 | 0.784091 |
469 | MLC | 0.40458 | 0.784091 |
470 | BCO | 0.40458 | 0.784091 |
471 | KGJ | 0.40458 | 0.734043 |
472 | 3HC | 0.40458 | 0.793103 |
473 | 5GP | 0.404255 | 0.881579 |
474 | G | 0.404255 | 0.881579 |
475 | R7I | 0.40404 | 0.893333 |
476 | R5I | 0.40404 | 0.893333 |
477 | G2Q | 0.403846 | 0.860759 |
478 | 3D1 | 0.402439 | 0.773333 |
479 | 3L1 | 0.402439 | 0.773333 |
480 | VRT | 0.402062 | 0.769231 |
481 | HZ2 | 0.401786 | 0.753086 |
482 | YE1 | 0.401515 | 0.813953 |
483 | LCV | 0.401515 | 0.704082 |
484 | CAA | 0.401515 | 0.793103 |
485 | MCA | 0.401515 | 0.775281 |
486 | SO5 | 0.401515 | 0.704082 |
487 | COO | 0.401515 | 0.784091 |
488 | Q2M | 0.4 | 0.690476 |
489 | 3NZ | 0.4 | 0.805195 |
490 | GMV | 0.4 | 0.871795 |
491 | CNV FAD | 0.4 | 0.793103 |
No: | Ligand | Similarity coefficient |
---|---|---|
1 | IMU | 0.9908 |
2 | EO7 | 0.9905 |
3 | IRP | 0.9761 |
4 | LMS | 0.9705 |
5 | 6CG | 0.9705 |
6 | FMP | 0.9702 |
7 | 8GM | 0.9670 |
8 | 6OG | 0.9662 |
9 | 8BR | 0.9643 |
10 | SRA | 0.9642 |
11 | D5M | 0.9581 |
12 | 8OP | 0.9576 |
13 | DI | 0.9557 |
14 | DA | 0.9551 |
15 | CMP | 0.9481 |
16 | 5HM | 0.9474 |
17 | 6SW | 0.9448 |
18 | AS | 0.9446 |
19 | 8OG | 0.9444 |
20 | AOC | 0.9444 |
21 | 6MA | 0.9412 |
22 | ZAS | 0.9407 |
23 | 5BU | 0.9398 |
24 | PFU | 0.9366 |
25 | NEC | 0.9346 |
26 | 7CH | 0.9345 |
27 | 3DH | 0.9341 |
28 | A3N | 0.9335 |
29 | FNU | 0.9328 |
30 | N5O | 0.9319 |
31 | CNU | 0.9319 |
32 | BRU | 0.9319 |
33 | 5AS | 0.9308 |
34 | 5CM | 0.9294 |
35 | NCN | 0.9288 |
36 | TMP | 0.9283 |
37 | NYM | 0.9281 |
38 | QBT | 0.9281 |
39 | 6SZ | 0.9279 |
40 | TKW | 0.9278 |
41 | Z8B | 0.9277 |
42 | 5FU | 0.9270 |
43 | UFP | 0.9262 |
44 | M2T | 0.9253 |
45 | NMN | 0.9252 |
46 | U5P | 0.9224 |
47 | MTA | 0.9223 |
48 | SP1 | 0.9219 |
49 | 7D5 | 0.9218 |
50 | 6SX | 0.9214 |
51 | 6RE | 0.9211 |
52 | J7C | 0.9211 |
53 | 5IU | 0.9207 |
54 | MZP | 0.9174 |
55 | 4X2 | 0.9152 |
56 | NWQ | 0.9140 |
57 | 5HU | 0.9140 |
58 | 9L3 | 0.9138 |
59 | C | 0.9123 |
60 | 2DT | 0.9120 |
61 | D4M | 0.9119 |
62 | BMQ | 0.9115 |
63 | BMP | 0.9108 |
64 | EP4 | 0.9107 |
65 | MCF | 0.9100 |
66 | UP6 | 0.9063 |
67 | RP1 | 0.9062 |
68 | 6J7 | 0.9056 |
69 | BVP | 0.9055 |
70 | DSH | 0.9040 |
71 | C5P | 0.9030 |
72 | O8M | 0.9029 |
73 | PRX | 0.9015 |
74 | UMP | 0.9002 |
75 | DC | 0.8991 |
76 | GJV | 0.8990 |
77 | DCM | 0.8989 |
78 | DU | 0.8989 |
79 | U | 0.8986 |
80 | NWZ | 0.8980 |
81 | H2U | 0.8974 |
82 | 3F5 | 0.8969 |
83 | SSI | 0.8968 |
84 | MTE | 0.8960 |
85 | NUP | 0.8946 |
86 | UMC | 0.8941 |
87 | GDP MG | 0.8932 |
88 | T3S | 0.8920 |
89 | S5P | 0.8919 |
90 | ICR | 0.8905 |
91 | FN5 | 0.8895 |
92 | CH | 0.8895 |
93 | 581 | 0.8894 |
94 | U6M | 0.8893 |
95 | PSU | 0.8871 |
96 | 16B | 0.8861 |
97 | M7G | 0.8859 |
98 | O02 | 0.8851 |
99 | 2FA | 0.8850 |
100 | CAR | 0.8849 |
101 | O7E | 0.8845 |
102 | DDN | 0.8844 |
103 | G5A | 0.8843 |
104 | A8M | 0.8839 |
105 | ADP MG | 0.8838 |
106 | 6CN | 0.8830 |
107 | DUS | 0.8828 |
108 | A3P | 0.8826 |
109 | OMP | 0.8819 |
110 | M33 | 0.8818 |
111 | AD3 | 0.8816 |
112 | ATM | 0.8807 |
113 | JW5 | 0.8806 |
114 | 43J | 0.8797 |
115 | T7O | 0.8794 |
116 | 6AU | 0.8793 |
117 | GNG | 0.8784 |
118 | ADN | 0.8778 |
119 | N8M | 0.8776 |
120 | 7DD | 0.8775 |
121 | U4S | 0.8771 |
122 | GAP | 0.8768 |
123 | 6AD | 0.8762 |
124 | ADX | 0.8760 |
125 | A4D | 0.8759 |
126 | 5CD | 0.8759 |
127 | 1BJ | 0.8754 |
128 | A2P | 0.8752 |
129 | S4M | 0.8752 |
130 | 43H | 0.8741 |
131 | IXF | 0.8739 |
132 | SON | 0.8729 |
133 | DOC | 0.8728 |
134 | FMC | 0.8728 |
135 | DBM | 0.8718 |
136 | 5YA | 0.8713 |
137 | NOC | 0.8713 |
138 | ARJ | 0.8713 |
139 | NWW | 0.8700 |
140 | U2S | 0.8699 |
141 | FKJ | 0.8695 |
142 | IY5 | 0.8695 |
143 | 13A | 0.8685 |
144 | 5N5 | 0.8683 |
145 | AU1 | 0.8679 |
146 | DAT | 0.8677 |
147 | Y3J | 0.8666 |
148 | CL9 | 0.8665 |
149 | IMH | 0.8665 |
150 | CC2 | 0.8659 |
151 | UA2 | 0.8658 |
152 | MG7 | 0.8657 |
153 | 2OM | 0.8656 |
154 | U3S | 0.8655 |
155 | U1S | 0.8655 |
156 | 100 | 0.8648 |
157 | M7M | 0.8647 |
158 | ECZ | 0.8641 |
159 | 2ZI | 0.8639 |
160 | 5FD | 0.8639 |
161 | O7M | 0.8636 |
162 | PNJ | 0.8629 |
163 | TBN | 0.8621 |
164 | RFZ | 0.8610 |
165 | 3AD | 0.8609 |
166 | GLC G6P | 0.8606 |
167 | IXE | 0.8598 |
168 | 5CJ | 0.8596 |
169 | M0Y | 0.8587 |
170 | LRT | 0.8587 |
171 | DN8 | 0.8586 |
172 | 824 | 0.8575 |
173 | 0NH | 0.8561 |
174 | IYX | 0.8555 |
175 | A5A | 0.8547 |
176 | 9W8 | 0.8546 |
177 | TXS | 0.8537 |
178 | 6SY | 0.8537 |
179 | 2GE | 0.8529 |
180 | 5ID | 0.8524 |
181 | 3BH | 0.8521 |
No: | Ligand | Similarity coefficient |
---|
This union binding pocket(no: 1) in the query (biounit: 2jc9.bio1) has 9 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 2) in the query (biounit: 2jc9.bio1) has 9 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 3) in the query (biounit: 2jc9.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |
This union binding pocket(no: 4) in the query (biounit: 2jc9.bio1) has 14 residues | |||
---|---|---|---|
No: | Leader PDB | Ligand | Sequence Similarity |