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Receptor
PDB id Resolution Class Description Source Keywords
2C49 1.92 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF METHANOCALDOCOCCUS JANNASCHII NUCLEOSIDE KINASE - AN ARCHAEAL MEMBER OF THE RIBOKINASE F AMILY METHANOCOCCUS JANNASCHII TRANSFERASE NUCLEOSIDE KINASE HYPERTHERMOPHILE RIBOKINASERIBOKINASE FOLD
Ref.: STRUCTURE OF METHANOCALDOCOCCUS JANNASCHII NUCLEOSI KINASE: AN ARCHAEAL MEMBER OF THE RIBOKINASE FAMILY ACTA CRYSTALLOGR.,SECT.D V. 62 1085 2006
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
ADN A:1301;
B:1301;
Valid;
Valid;
none;
none;
submit data
267.241 C10 H13 N5 O4 c1nc(...
ANP A:1304;
B:1304;
Valid;
Valid;
none;
none;
submit data
506.196 C10 H17 N6 O12 P3 c1nc(...
MG A:1302;
A:1303;
B:1302;
B:1303;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
24.305 Mg [Mg+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2C49 1.92 Å EC: 2.-.-.- CRYSTAL STRUCTURE OF METHANOCALDOCOCCUS JANNASCHII NUCLEOSIDE KINASE - AN ARCHAEAL MEMBER OF THE RIBOKINASE F AMILY METHANOCOCCUS JANNASCHII TRANSFERASE NUCLEOSIDE KINASE HYPERTHERMOPHILE RIBOKINASERIBOKINASE FOLD
Ref.: STRUCTURE OF METHANOCALDOCOCCUS JANNASCHII NUCLEOSI KINASE: AN ARCHAEAL MEMBER OF THE RIBOKINASE FAMILY ACTA CRYSTALLOGR.,SECT.D V. 62 1085 2006
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 269 families.
1 2C49 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 237 families.
1 2C49 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 187 families.
1 2C49 - ANP C10 H17 N6 O12 P3 c1nc(c2c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: ADN; Similar ligands found: 305
No: Ligand ECFP6 Tc MDL keys Tc
1 RAB 1 1
2 ADN 1 1
3 XYA 1 1
4 5N5 0.811321 0.967742
5 5CD 0.796296 0.920635
6 A4D 0.796296 0.967742
7 MTA 0.758621 0.878788
8 EP4 0.754386 0.852941
9 M2T 0.741379 0.828571
10 DTA 0.741379 0.865672
11 AMP 0.709677 0.842857
12 A 0.709677 0.842857
13 3DH 0.704918 0.878788
14 ZAS 0.68254 0.84058
15 LMS 0.68254 0.7375
16 5AD 0.672727 0.854839
17 SRA 0.671875 0.797297
18 6RE 0.671875 0.830986
19 DSH 0.661538 0.842857
20 AOC 0.661538 0.907692
21 7D7 0.660714 0.875
22 ABM 0.651515 0.819444
23 A2D 0.651515 0.84507
24 J7C 0.651515 0.842857
25 A3N 0.651515 0.923077
26 ADP 0.647059 0.84507
27 S4M 0.641791 0.766234
28 GJV 0.641791 0.819444
29 3AM 0.640625 0.828571
30 AN2 0.637681 0.833333
31 BA3 0.632353 0.84507
32 A12 0.632353 0.810811
33 AP2 0.632353 0.810811
34 MAO 0.632353 0.75641
35 Y3J 0.627119 0.828125
36 5AS 0.623188 0.714286
37 AP5 0.623188 0.84507
38 B4P 0.623188 0.84507
39 ATP 0.619718 0.84507
40 HEJ 0.619718 0.84507
41 5X8 0.619718 0.865672
42 AT4 0.614286 0.810811
43 A7D 0.614286 0.909091
44 SON 0.614286 0.786667
45 5FA 0.611111 0.84507
46 AQP 0.611111 0.84507
47 APC 0.611111 0.810811
48 26A 0.606557 0.893939
49 2FA 0.606557 0.924242
50 ADX 0.605634 0.759494
51 AU1 0.605634 0.821918
52 CA0 0.605634 0.821918
53 MHZ 0.605634 0.75641
54 M33 0.605634 0.833333
55 AGS 0.60274 0.8
56 AD9 0.60274 0.821918
57 SAP 0.60274 0.8
58 2AM 0.6 0.842857
59 ACP 0.597222 0.821918
60 SFG 0.597222 0.850746
61 50T 0.597222 0.833333
62 MTP 0.590164 0.852941
63 APR 0.589041 0.84507
64 PRX 0.589041 0.797297
65 AR6 0.589041 0.84507
66 A3G 0.588235 0.938462
67 ACQ 0.586667 0.821918
68 T99 0.586667 0.810811
69 TAT 0.586667 0.810811
70 A3P 0.585714 0.816901
71 SA8 0.581081 0.794521
72 RBY 0.581081 0.810811
73 A5D 0.581081 0.865672
74 ADP PO3 0.581081 0.842857
75 ADV 0.581081 0.810811
76 6MD 0.580645 0.952381
77 1DA 0.580645 1
78 ADQ 0.575 0.847222
79 OVE 0.573529 0.808219
80 SAH 0.573333 0.84058
81 G5A 0.573333 0.714286
82 SAI 0.573333 0.828571
83 A22 0.56962 0.833333
84 ANP 0.565789 0.821918
85 GAP 0.565789 0.821918
86 SAM 0.565789 0.773333
87 NEC 0.565217 0.876923
88 3AD 0.564516 0.951613
89 6YZ 0.564103 0.821918
90 25A 0.5625 0.819444
91 7D5 0.560606 0.780822
92 5AL 0.558442 0.808219
93 AAT 0.558442 0.819444
94 EEM 0.558442 0.773333
95 ADP ALF 0.551282 0.776316
96 ATF 0.551282 0.810811
97 A5A 0.551282 0.719512
98 ALF ADP 0.551282 0.776316
99 CC5 0.55 0.935484
100 A3S 0.547945 0.953125
101 SSA 0.544304 0.73494
102 S7M 0.544304 0.773333
103 ADP VO4 0.544304 0.808219
104 VO4 ADP 0.544304 0.808219
105 SRP 0.544304 0.810811
106 SMM 0.544304 0.74359
107 QQX 0.544118 0.756757
108 S8M 0.54321 0.805556
109 ADP BMA 0.542169 0.847222
110 A2P 0.541667 0.802817
111 3L1 0.539683 0.907692
112 3D1 0.539683 0.907692
113 PAP 0.539474 0.830986
114 VMS 0.5375 0.702381
115 52H 0.5375 0.694118
116 54H 0.5375 0.702381
117 LSS 0.536585 0.678161
118 QQY 0.536232 0.767123
119 ACK 0.536232 0.811594
120 A3T 0.533333 0.968254
121 53H 0.530864 0.694118
122 5CA 0.530864 0.73494
123 TSB 0.530864 0.731707
124 8X1 0.530864 0.689655
125 MAP 0.530864 0.8
126 DAL AMP 0.530864 0.808219
127 OOB 0.52439 0.808219
128 9ZA 0.52439 0.766234
129 8QN 0.52439 0.808219
130 5SV 0.52439 0.75641
131 9ZD 0.52439 0.766234
132 GEK 0.52439 0.805556
133 OAD 0.52381 0.821918
134 9X8 0.52381 0.8
135 25L 0.523256 0.833333
136 PPS 0.518987 0.7375
137 DSZ 0.518072 0.714286
138 AMO 0.518072 0.810811
139 A1R 0.518072 0.813333
140 A3R 0.518072 0.813333
141 0UM 0.518072 0.808219
142 4AD 0.518072 0.8
143 PAJ 0.518072 0.792208
144 NSS 0.518072 0.714286
145 A A 0.517647 0.819444
146 6CR 0.515152 0.910448
147 SP1 0.514286 0.77027
148 RP1 0.514286 0.77027
149 2VA 0.513158 0.938462
150 DLL 0.511905 0.808219
151 AHX 0.511905 0.802632
152 00A 0.511905 0.766234
153 62X 0.511905 0.74359
154 NVA LMS 0.511905 0.670455
155 3OD 0.511628 0.821918
156 PTJ 0.511628 0.75641
157 ME8 0.511628 0.728395
158 7D3 0.506849 0.783784
159 V3L 0.506329 0.819444
160 A6D 0.505882 0.763158
161 LEU LMS 0.505882 0.670455
162 K15 0.505882 0.763158
163 3UK 0.505882 0.797297
164 GSU 0.5 0.694118
165 B5V 0.5 0.786667
166 P5A 0.5 0.681818
167 KAA 0.5 0.689655
168 NVA 2AD 0.5 0.884058
169 PR8 0.5 0.759494
170 CMP 0.5 0.826087
171 LAD 0.5 0.769231
172 ATR 0.5 0.816901
173 5F1 0.5 0.80597
174 2BA 0.5 0.814286
175 WAQ 0.5 0.766234
176 AD3 0.5 1
177 ATP A A A 0.494382 0.830986
178 9K8 0.494253 0.670455
179 JB6 0.494253 0.766234
180 1ZZ 0.494253 0.728395
181 FYA 0.494253 0.808219
182 SXZ 0.494253 0.773333
183 TXA 0.494253 0.810811
184 BIS 0.494253 0.789474
185 NB8 0.494253 0.779221
186 SO8 0.493671 0.924242
187 VRT 0.493671 0.897059
188 IVH 0.493333 0.835616
189 KB1 0.488636 0.783784
190 MYR AMP 0.488636 0.728395
191 2A5 0.487179 0.797297
192 NOC 0.484375 0.903226
193 4UV 0.483516 0.776316
194 9SN 0.483146 0.75641
195 A2R 0.481928 0.833333
196 7D4 0.480519 0.783784
197 FA5 0.477778 0.786667
198 YAP 0.477778 0.776316
199 B5Y 0.477778 0.776316
200 B5M 0.477778 0.776316
201 8PZ 0.477778 0.714286
202 D3Y 0.47619 0.924242
203 AR6 AR6 0.473118 0.819444
204 AFH 0.473118 0.792208
205 YSA 0.472527 0.694118
206 XAH 0.472527 0.75
207 EKK 0.469697 0.923077
208 TBN 0.46875 0.983607
209 3BH 0.46875 0.953125
210 AMP DBH 0.467391 0.821918
211 TYR AMP 0.467391 0.776316
212 101 0.465753 0.780822
213 LAQ 0.463158 0.728395
214 TO1 0.462687 0.952381
215 G3A 0.462366 0.779221
216 7C5 0.462366 0.819444
217 UPA 0.459184 0.813333
218 LPA AMP 0.458333 0.728395
219 G5P 0.457447 0.779221
220 7MD 0.457447 0.772152
221 ARG AMP 0.457447 0.740741
222 4UU 0.457447 0.776316
223 GA7 0.457447 0.835616
224 A A A 0.454545 0.808219
225 EKH 0.454545 0.923077
226 5ID 0.454545 0.923077
227 TAD 0.452632 0.769231
228 4YB 0.452632 0.678161
229 GTA 0.452632 0.75
230 KH3 0.452632 0.776316
231 DQV 0.452632 0.833333
232 3NZ 0.449438 0.884058
233 WSA 0.44898 0.702381
234 OMR 0.44898 0.740741
235 TYM 0.44898 0.786667
236 AHZ 0.447917 0.728395
237 FTU 0.447761 0.923077
238 139 0.445545 0.782051
239 YLP 0.443299 0.731707
240 48N 0.443299 0.779221
241 AFX 0.441176 0.768116
242 ARJ 0.441176 0.857143
243 AV2 0.440476 0.77027
244 DA 0.44 0.756757
245 D5M 0.44 0.756757
246 5J9 0.43956 0.773333
247 UP5 0.438776 0.8
248 NAI 0.438776 0.789474
249 NXX 0.438776 0.810811
250 NAX 0.438776 0.759494
251 6V0 0.438776 0.779221
252 4UW 0.438776 0.746835
253 TXD 0.438776 0.789474
254 DND 0.438776 0.810811
255 NA7 0.438202 0.810811
256 PO4 PO4 A A A A PO4 0.438202 0.802817
257 MZR 0.4375 0.859375
258 V1N 0.43617 0.819444
259 HO4 0.434783 0.952381
260 TXE 0.434343 0.789474
261 649 0.434343 0.662921
262 AF3 ADP 3PG 0.434343 0.746835
263 IMO 0.434211 0.777778
264 3AT 0.433735 0.819444
265 G A A A 0.432692 0.779221
266 8Q2 0.43 0.689655
267 F0P 0.43 0.794521
268 AP0 0.43 0.779221
269 7MC 0.43 0.753086
270 YLC 0.43 0.75
271 YLB 0.43 0.731707
272 4TC 0.43 0.779221
273 SGV 0.428571 0.967742
274 BS5 0.427184 0.674157
275 A4P 0.425743 0.73494
276 IOT 0.421569 0.722892
277 DAT 0.419753 0.76
278 COD 0.419048 0.72619
279 T5A 0.417476 0.731707
280 ADJ 0.417476 0.740741
281 YLA 0.417476 0.731707
282 AS 0.415584 0.717949
283 J1D 0.415094 0.625
284 0XU 0.414634 0.823529
285 CNA 0.413462 0.810811
286 AYB 0.413462 0.722892
287 103 0.413333 0.716216
288 A U 0.411765 0.8
289 80F 0.411215 0.731707
290 GMP 0.410959 0.882353
291 EO7 0.410256 0.702381
292 F2R 0.409524 0.753086
293 GGZ 0.409091 0.7125
294 U A 0.407407 0.766234
295 ITT 0.407407 0.791667
296 A G 0.40566 0.766234
297 BTX 0.40566 0.710843
298 4TA 0.40566 0.719512
299 NAD 0.40566 0.808219
300 AMP NAD 0.40566 0.808219
301 SFB 0.401961 0.709302
302 DZD 0.401869 0.769231
303 U A G G 0.401869 0.766234
304 BT5 0.401869 0.702381
305 DTP 0.4 0.76
Ligand no: 2; Ligand: ANP; Similar ligands found: 373
No: Ligand ECFP6 Tc MDL keys Tc
1 ANP 1 1
2 A2D 0.810811 0.945205
3 B4P 0.802632 0.945205
4 AP5 0.802632 0.945205
5 ADP 0.802632 0.972222
6 BA3 0.789474 0.945205
7 AU1 0.782051 1
8 HEJ 0.772152 0.972222
9 ATP 0.772152 0.972222
10 AT4 0.769231 0.933333
11 AN2 0.769231 0.986111
12 5FA 0.7625 0.972222
13 AQP 0.7625 0.972222
14 M33 0.759494 0.932432
15 MAP 0.752941 0.972973
16 ACP 0.75 0.945946
17 AR6 0.740741 0.945205
18 APR 0.740741 0.945205
19 ACQ 0.73494 0.945946
20 AD9 0.731707 0.945946
21 SAP 0.731707 0.921053
22 AGS 0.731707 0.921053
23 A 0.723684 0.944444
24 AMP 0.723684 0.944444
25 ATF 0.717647 0.933333
26 ADX 0.716049 0.851852
27 CA0 0.716049 0.92
28 6YZ 0.709302 0.945946
29 50T 0.707317 0.932432
30 PRX 0.698795 0.87013
31 ABM 0.696203 0.893333
32 AP2 0.679012 0.933333
33 A12 0.679012 0.933333
34 APC 0.678571 0.933333
35 T99 0.674419 0.933333
36 TAT 0.674419 0.933333
37 A22 0.674157 0.958904
38 SRA 0.670886 0.894737
39 SRP 0.670455 0.883117
40 5AL 0.666667 0.906667
41 A1R 0.659341 0.884615
42 ADQ 0.659341 0.92
43 A3R 0.659341 0.884615
44 3OD 0.648936 0.92
45 BIS 0.648936 0.909091
46 5SV 0.648352 0.82716
47 9X8 0.645161 0.896104
48 OAD 0.645161 0.92
49 25L 0.642105 0.958904
50 AMO 0.641304 0.907895
51 G5P 0.636364 0.897436
52 DLL 0.634409 0.906667
53 AHX 0.634409 0.897436
54 00A 0.634409 0.860759
55 ADV 0.632184 0.907895
56 RBY 0.632184 0.907895
57 ADP PO3 0.632184 0.917808
58 NB8 0.631579 0.897436
59 25A 0.630435 0.945205
60 OOB 0.630435 0.906667
61 8QN 0.630435 0.906667
62 G3A 0.626263 0.897436
63 4AD 0.623656 0.896104
64 PAJ 0.623656 0.8625
65 LAD 0.621053 0.839506
66 TXA 0.614583 0.907895
67 1ZZ 0.614583 0.819277
68 ME8 0.614583 0.819277
69 GTA 0.613861 0.864198
70 9ZD 0.612903 0.909091
71 9ZA 0.612903 0.909091
72 3UK 0.610526 0.894737
73 SON 0.604651 0.907895
74 ADP ALF 0.604396 0.848101
75 ALF ADP 0.604396 0.848101
76 PR8 0.604167 0.829268
77 B5V 0.604167 0.883117
78 WAQ 0.604167 0.860759
79 4UV 0.6 0.871795
80 GAP 0.6 0.87013
81 PTJ 0.597938 0.873418
82 FYA 0.597938 0.881579
83 VO4 ADP 0.597826 0.906667
84 ADP VO4 0.597826 0.906667
85 LMS 0.597561 0.829268
86 UP5 0.596154 0.896104
87 FA5 0.59596 0.883117
88 YAP 0.59596 0.871795
89 PAP 0.595506 0.958333
90 A4P 0.59434 0.823529
91 XAH 0.59 0.841463
92 4UU 0.588235 0.871795
93 AFH 0.588235 0.8625
94 9SN 0.585859 0.85
95 2A5 0.58427 0.894737
96 T5A 0.583333 0.821429
97 DQV 0.582524 0.932432
98 NAI 0.580952 0.884615
99 B5M 0.58 0.871795
100 B5Y 0.58 0.871795
101 ITT 0.579545 0.917808
102 ATR 0.577778 0.944444
103 OMR 0.575472 0.831325
104 5AS 0.574713 0.781609
105 YLP 0.571429 0.8
106 48N 0.571429 0.873418
107 AP0 0.570093 0.873418
108 4TC 0.570093 0.873418
109 7D3 0.569767 0.881579
110 ADJ 0.568807 0.831325
111 GNP 0.568421 0.922078
112 9GM 0.568421 0.922078
113 DAL AMP 0.568421 0.881579
114 6V0 0.566038 0.873418
115 TXD 0.566038 0.884615
116 DND 0.566038 0.907895
117 NAX 0.566038 0.851852
118 4UW 0.566038 0.839506
119 NXX 0.566038 0.907895
120 XYA 0.565789 0.821918
121 RAB 0.565789 0.821918
122 ADN 0.565789 0.821918
123 AOC 0.564706 0.8
124 7D4 0.561798 0.881579
125 ADP BMA 0.561224 0.894737
126 TXE 0.560748 0.884615
127 TYM 0.560748 0.883117
128 GA7 0.557692 0.883117
129 YLC 0.555556 0.819277
130 YLB 0.555556 0.8
131 139 0.554545 0.851852
132 5N5 0.551282 0.797297
133 JB6 0.55 0.860759
134 LAQ 0.54717 0.819277
135 F2R 0.544643 0.843373
136 MYR AMP 0.544554 0.797619
137 5CD 0.544304 0.783784
138 A4D 0.544304 0.797297
139 80F 0.54386 0.821429
140 7MD 0.542857 0.864198
141 6AD 0.542553 0.886076
142 A2R 0.541667 0.958904
143 UPA 0.541284 0.884615
144 YLA 0.540541 0.8
145 A A 0.54 0.918919
146 BTX 0.539823 0.821429
147 COD 0.539823 0.793103
148 HFD 0.537634 0.921053
149 G5A 0.537634 0.781609
150 3DH 0.535714 0.753247
151 AYB 0.535714 0.790698
152 CNA 0.535714 0.907895
153 BT5 0.535088 0.811765
154 ATP A A A 0.533981 0.905405
155 IOT 0.531532 0.811765
156 MTA 0.53012 0.753247
157 3AM 0.529412 0.90411
158 A3P 0.52809 0.944444
159 PPS 0.526316 0.851852
160 NAD 0.526316 0.906667
161 EP4 0.52439 0.734177
162 7D5 0.52381 0.855263
163 AMP DBH 0.52381 0.87013
164 J7C 0.522727 0.75
165 A5A 0.520833 0.809524
166 EAD 0.520661 0.851852
167 TSB 0.520408 0.821429
168 AHZ 0.518519 0.797619
169 DTA 0.518072 0.766234
170 M2T 0.518072 0.716049
171 A3D 0.517241 0.894737
172 6RE 0.517241 0.740741
173 YLY 0.516949 0.790698
174 SSA 0.515464 0.802326
175 NA7 0.514852 0.933333
176 ARG AMP 0.514019 0.809524
177 AR6 AR6 0.514019 0.893333
178 7MC 0.513514 0.843373
179 A2P 0.511111 0.930556
180 52H 0.510204 0.781609
181 VMS 0.510204 0.790698
182 54H 0.510204 0.790698
183 TYR AMP 0.509434 0.848101
184 TAD 0.509259 0.8625
185 NAQ 0.508333 0.85
186 A3N 0.505618 0.766234
187 AV2 0.505155 0.893333
188 53H 0.50505 0.781609
189 5CA 0.50505 0.802326
190 8X1 0.50505 0.755556
191 ARU 0.504951 0.839506
192 ZID 0.504132 0.894737
193 P1H 0.504 0.831325
194 NAE 0.5 0.871795
195 3AT 0.5 0.945205
196 AVV 0.5 0.873418
197 P5A 0.495146 0.747253
198 NSS 0.49505 0.802326
199 LSS 0.49505 0.764045
200 DSZ 0.49505 0.802326
201 N0B 0.491803 0.8
202 AF3 ADP 3PG 0.491071 0.817073
203 NVA LMS 0.490196 0.755556
204 DAT 0.489362 0.881579
205 IMO 0.488889 0.90411
206 ZAS 0.488636 0.792208
207 FDA 0.488372 0.813953
208 NAJ PZO 0.487395 0.85
209 4TA 0.487179 0.788235
210 LPA AMP 0.486486 0.797619
211 LEU LMS 0.485437 0.755556
212 DTP 0.484536 0.881579
213 V3L 0.484536 0.945205
214 S4M 0.483516 0.651685
215 GJV 0.483516 0.731707
216 DZD 0.483051 0.8625
217 2AM 0.482759 0.917808
218 5AD 0.481013 0.726027
219 GSU 0.480769 0.781609
220 KAA 0.480769 0.755556
221 NDE 0.480315 0.907895
222 M24 0.479339 0.851852
223 MAO 0.478261 0.761905
224 NEC 0.477778 0.727273
225 DSH 0.477778 0.707317
226 FAS 0.477273 0.831325
227 FAD 0.477273 0.831325
228 RGT 0.476636 0.933333
229 9K8 0.47619 0.698925
230 G A A A 0.474576 0.85
231 0WD 0.474576 0.897436
232 FNK 0.474074 0.786517
233 5X8 0.473684 0.74359
234 6FA 0.473282 0.821429
235 NDC 0.472868 0.85
236 FB0 0.472868 0.786517
237 YSA 0.472222 0.781609
238 7DD 0.468085 0.958333
239 OVE 0.466667 0.881579
240 MHZ 0.463158 0.701149
241 8PZ 0.462963 0.802326
242 A G 0.462185 0.860759
243 AMP NAD 0.462185 0.881579
244 A3G 0.461538 0.779221
245 NAJ PYZ 0.459677 0.809524
246 6C6 0.459184 0.858974
247 SFG 0.458333 0.730769
248 U A G G 0.458333 0.860759
249 7D7 0.45679 0.723684
250 128 0.45614 0.8
251 SFD 0.455224 0.736842
252 6IA 0.454545 0.817073
253 DDS 0.454545 0.855263
254 GDP 0.454545 0.896104
255 ODP 0.453782 0.886076
256 NJP 0.453782 0.921053
257 7DT 0.453608 0.958333
258 A7D 0.452632 0.75641
259 Z5A 0.452381 0.802326
260 WSA 0.452174 0.790698
261 U A 0.45082 0.884615
262 7C5 0.45045 0.797468
263 FAY 0.449275 0.841463
264 NDP 0.449153 0.897436
265 SA8 0.44898 0.690476
266 A5D 0.44898 0.766234
267 71V 0.446809 0.884615
268 GGZ 0.446602 0.804878
269 RFL 0.446043 0.802326
270 2SA 0.445545 0.907895
271 SAI 0.444444 0.716049
272 GP3 0.444444 0.897436
273 SAH 0.444444 0.725
274 PO4 PO4 A A A A PO4 0.443396 0.878378
275 A A A 0.443396 0.881579
276 4YB 0.442478 0.764045
277 SMM 0.441176 0.670455
278 S7M 0.441176 0.674419
279 GTP 0.441176 0.896104
280 Y3J 0.440476 0.706667
281 SAM 0.44 0.674419
282 649 0.439655 0.747253
283 12D 0.438596 0.809524
284 A3S 0.4375 0.789474
285 NPW 0.436975 0.864198
286 GCP 0.436893 0.873418
287 AAT 0.435644 0.690476
288 GNH 0.435644 0.909091
289 EEM 0.435644 0.674419
290 ETB 0.435484 0.813953
291 DCA 0.435484 0.804598
292 N6P 0.433962 0.890411
293 NZQ 0.433333 0.886076
294 TXP 0.433333 0.897436
295 PGS 0.43299 0.860759
296 APU 0.432203 0.871795
297 PUA 0.432 0.8625
298 62F 0.431655 0.841463
299 F2N 0.431507 0.795455
300 DA 0.430108 0.855263
301 D5M 0.430108 0.855263
302 J7V 0.429688 0.813953
303 NIA 0.428571 0.848101
304 COA 0.428571 0.804598
305 6K6 0.428571 0.905405
306 A3T 0.428571 0.8
307 0T1 0.428571 0.804598
308 P5F 0.427586 0.804598
309 AAM 0.425532 0.944444
310 0UM 0.424528 0.682353
311 8Q2 0.423729 0.775281
312 G1R 0.423077 0.884615
313 AMZ 0.422222 0.891892
314 C2R 0.422222 0.88
315 A U 0.420168 0.848101
316 IDP 0.42 0.894737
317 GSP 0.419048 0.851852
318 30N 0.418605 0.736842
319 CAO 0.418605 0.777778
320 DG1 0.418605 0.897436
321 1DG 0.418605 0.897436
322 COS 0.418605 0.786517
323 AMX 0.418605 0.813953
324 TM1 0.418182 0.797619
325 A6D 0.416667 0.746988
326 K15 0.416667 0.666667
327 V1N 0.415929 0.893333
328 CMX 0.415385 0.804598
329 SCO 0.415385 0.804598
330 GEK 0.415094 0.719512
331 XNP 0.414634 0.851852
332 NHD 0.414634 0.881579
333 9JJ 0.413793 0.841463
334 AIR 0.413793 0.876712
335 COK 0.413534 0.786517
336 G2R 0.412844 0.8625
337 ACO 0.412214 0.777778
338 FAM 0.412214 0.786517
339 FCX 0.412214 0.777778
340 NAP 0.410853 0.92
341 FA9 0.409396 0.843373
342 SXZ 0.409091 0.694118
343 HAX 0.409091 0.806818
344 TAP 0.407692 0.884615
345 2MC 0.407407 0.752688
346 62X 0.407407 0.651685
347 GKE 0.40708 0.8625
348 GDC 0.40708 0.8625
349 GDD 0.40708 0.8625
350 3KK 0.406015 0.786517
351 FYN 0.406015 0.804598
352 NVA 2AD 0.405941 0.740741
353 NA0 0.40458 0.907895
354 101 0.404255 0.855263
355 G 0.40404 0.883117
356 5GP 0.40404 0.883117
357 HDV 0.403846 0.87013
358 MGP 0.403846 0.8625
359 OXK 0.402985 0.786517
360 MCD 0.402985 0.786517
361 CA6 0.402985 0.714286
362 SOP 0.402985 0.786517
363 3AD 0.402299 0.783784
364 S8M 0.401869 0.78481
365 YE1 0.40146 0.795455
366 NMX 0.4 0.782609
367 7RP 0.4 0.902778
368 2VA 0.4 0.779221
369 1VU 0.4 0.777778
370 CO6 0.4 0.786517
371 CMC 0.4 0.786517
372 6G0 0.4 0.8625
373 GMV 0.4 0.873418
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2C49; Ligand: ADN; Similar sites found with APoc: 230
This union binding pocket(no: 1) in the query (biounit: 2c49.bio1) has 20 residues
No: Leader PDB Ligand Sequence Similarity
1 4WG0 CHD None
2 2YJ0 420 None
3 3WUD GLC GAL None
4 1F9V ADP 1.3245
5 6D61 4AA 1.53846
6 5M67 ADE 1.65563
7 5M67 NAD 1.65563
8 5M67 3D1 1.65563
9 1W3T 3GR 1.70068
10 4DBH OXL 1.73611
11 5GLT BGC GAL NAG GAL 1.76056
12 2QX0 PH2 1.88679
13 4CNO 9PY 1.98413
14 1UNB PN1 1.98676
15 1UNB AKG 1.98676
16 4PIV NDP 1.98676
17 4RD0 GDP 1.98676
18 4WOE ADP 1.98676
19 2RDE C2E 1.99203
20 1Y9Q MED 2.08333
21 6MPT C30 2.0979
22 3NV3 GAL NAG MAN 2.17391
23 3KYG 5GP 5GP 2.20264
24 1UA4 BGC 2.31788
25 1UA4 GLC 2.31788
26 3JQ3 ADP 2.31788
27 3DRW AMP 2.31788
28 3ZGJ RMN 2.31788
29 4WCX MET 2.31788
30 2OVW CBI 2.31788
31 3FSY SCA 2.31788
32 6F3M NAD 2.31788
33 5EO8 TFU 2.31788
34 5A5W GUO 2.37154
35 3WBG 2AN 2.61438
36 5OD2 GLC 2.64901
37 2R5V HHH 2.64901
38 3CXO 3LR 2.64901
39 5ZI9 FLC 2.69231
40 4FFG 0U8 2.98013
41 3T7V MD0 2.98013
42 3GL0 HXX 2.98013
43 5VE5 GSH 2.98013
44 1SDW IYT 2.98013
45 5E58 CPZ 2.98013
46 5JSP DQY 2.98507
47 3KYF 5GP 5GP 3.0303
48 1E6W NAD 3.07692
49 6FOG OXL 3.125
50 4K55 H6P 3.22581
51 6EQS BV8 3.27273
52 5NFB 8VT 3.31126
53 6C1S EFV 3.31126
54 6F90 MVL 3.31126
55 2XVD AS6 3.31126
56 1Z45 GAL 3.31126
57 4GN8 ASO 3.34448
58 3WG3 A2G GAL NAG FUC 3.37079
59 5NC1 NAG 3.37553
60 4RFM 3P6 3.38346
61 2HZQ STR 3.44828
62 4DZ1 DAL 3.4749
63 3G5D 1N1 3.4965
64 3PH4 AOS 3.5503
65 6FOF LAT 3.57143
66 5EJL C2E 3.62903
67 1KC7 PPR 3.64238
68 2FCU AKG 3.64238
69 1YFS ALA 3.64238
70 5EOB 5QQ 3.64238
71 1T9D PYD 3.64238
72 4TWL ASC 3.65854
73 6BE3 NAG 3.68664
74 2EB5 OXL 3.74532
75 3E85 BSU 3.79747
76 3RGA LSB 3.88693
77 5XLY C2E 3.91459
78 2HRL SIA GAL SIA BGC NGA CEQ 3.93701
79 2VDF OCT 3.95257
80 1OFZ FUC 3.97351
81 1ZGS XMM 3.97351
82 1OFZ FUL 3.97351
83 3HEE R5P 4.02685
84 3L5R 47X 4.09836
85 5DRB 5FJ 4.12371
86 1I82 BGC BGC 4.2328
87 3PP0 03Q 4.30464
88 5HSA FAS 4.30464
89 2GJ5 VD3 4.32099
90 3VV1 GAL FUC 4.375
91 4XF6 ADP 4.3956
92 4XF6 INS 4.3956
93 4XF6 LIP 4.3956
94 5T7I LAT NAG GAL 4.51613
95 5FUI APY 4.54545
96 3G2Y GF4 4.56274
97 5JBX MLI 4.5977
98 3NZ1 3NY 4.5977
99 4GNC ASO 4.68227
100 4C5N ACP 4.71014
101 5XWC 2IT 4.96689
102 5XWC 8GL 4.96689
103 5XWC NAP 4.96689
104 43CA NPO 5.12821
105 2QL9 CIT 5.15464
106 1MEX RAC 5.16432
107 4GGZ BTN 5.21739
108 1SLT NDG GAL 5.22388
109 5TPV TYD 5.22876
110 6G0X RAM GLC GLA NAG NDG NAG 5.29801
111 3D91 REM 5.29801
112 1QIN GIP 5.46448
113 5V3D FCN 5.51724
114 4WVW SLT 5.55556
115 3VKC FPQ 5.59441
116 2XK9 XK9 5.62914
117 2ZJ1 ARJ 5.62914
118 2ZJ1 NAD 5.62914
119 4M1U A2G MBG 5.71429
120 4MA6 28E 5.73248
121 1QY1 PRZ 5.74713
122 2Q1A 2KT 5.80205
123 4RYV ZEA 5.80645
124 5OCG 9R5 5.82011
125 6GNO XDI 5.92593
126 3EW2 BTN 5.92593
127 5LNW RP5 5.96026
128 1ZZ7 S0H 6.06061
129 3SCH TB6 6.06061
130 1TT8 PHB 6.09756
131 1WYV PLP AOA 6.16438
132 5E62 Z3Q GAL 5N6 6.29139
133 6FYZ EBE 6.29139
134 5E65 5N6 GAL 6.29139
135 6FA4 D1W 6.35838
136 5AIG VPR 6.4
137 2OVD DAO 6.59341
138 5O0J GLC 6.62252
139 5O5Y GLC 6.62252
140 1VA6 ADP 6.62252
141 1VA6 P2S 6.62252
142 4KQP GLN 6.89655
143 5KJW 53C 6.95364
144 4WZH FMN 6.95364
145 5X1M DHB 6.95364
146 5X1M THG 6.95364
147 1SO0 GAL 6.95364
148 2Z93 END 7.04225
149 5A89 FMN 7.05128
150 5A89 ADP 7.05128
151 5XQW 8EU 7.109
152 4Y24 TD2 7.14286
153 4F7E 0SH 7.14286
154 1Y7P RIP 7.17489
155 4JH6 FCN 7.24638
156 5L2R MLA 7.28477
157 2BES RES 7.55814
158 4OPC PGT 7.61589
159 4OPC FDA 7.61589
160 4BS0 6NT 7.61589
161 2X34 UQ8 7.73481
162 2X32 OTP 7.82123
163 1UMZ BGC BGC XYS BGC XYS GAL 7.91367
164 5LY2 OGA 7.94702
165 5FWE OGA 7.94702
166 1VKF CIT 7.97872
167 5Y4R C2E 8.16327
168 4H6B 10X 8.20513
169 1S7G NAD 8.3004
170 1Q6O LG6 8.33333
171 3QRC SCR 8.9172
172 2F2U M77 8.9404
173 1REQ DCA 8.9404
174 4WO4 JLS 9
175 3EXS 5RP 9.04977
176 5U98 1KX 9.09091
177 5FAW CHT 9.60265
178 2YKL NLD 9.72222
179 2NNQ T4B 9.92366
180 1OFL NGK GCD 9.93377
181 2XIQ MLC 10.2649
182 5FU3 BGC BGC BGC 10.3774
183 5TBM 79A 10.4348
184 5A0U CHT 10.596
185 2FUE M1P 10.687
186 2VL1 GLY GLY 10.9272
187 1OVD FMN 10.9272
188 1OVD ORO 10.9272
189 2P7Q GG6 11.2782
190 4XZ3 ACP 11.3043
191 4XYM COA 11.3043
192 1PVN MZP 11.4362
193 1P0Z FLC 11.4504
194 4M3P HCS 11.5894
195 5DEX GLY 11.6438
196 4R3U 3HC 12.0253
197 4R3U 3KK 12.0253
198 2BS5 BGC GAL FUC 12.2222
199 1Q7L GLY 12.5
200 2Y88 2ER 12.7049
201 3K7S R52 12.8492
202 4RT1 C2E 13.3929
203 2WW2 SWA 13.5762
204 1KJ1 MAN 13.7615
205 2VAR KDG 14.2384
206 2VAR KDF 14.2384
207 4LIT AKG 14.2384
208 4D1J DGJ 14.2384
209 2YI0 YI0 14.8472
210 3MTX PGT 16.5563
211 4W6Z ETF 16.8874
212 2JG1 TA6 19.2053
213 3LOO B4P 20.8609
214 2H29 DND 21.164
215 5YRV 5AD 21.1679
216 3OTX AP5 23.1788
217 2ABS ACP 23.5099
218 4NS0 PIO 24.812
219 2HO2 PRO PRO PRO PRO PRO PRO PRO PRO PRO LEU 26.3158
220 4MNS 2AX 29.5597
221 5YSQ INS 30.7692
222 2I6A 5I5 36.4238
223 2HW1 FRU 40.2685
224 4XDA ADP 41.0596
225 4XDA RIB 41.0596
226 3NC9 TR3 41.3907
227 4PVV HO4 41.7219
228 1RKD ADP 43.0464
229 1RKD RIB 43.0464
230 3B1Q NOS 46.6887
Pocket No.: 2; Query (leader) PDB : 2C49; Ligand: ANP; Similar sites found with APoc: 92
This union binding pocket(no: 2) in the query (biounit: 2c49.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 6BKK 308 None
2 6BKL RIM None
3 6BKL EU7 None
4 1GOJ ADP 1.3245
5 1LVW TYD 1.69492
6 3TAY MN0 1.84049
7 5EPO TUD 1.9084
8 2W41 ADP 1.98676
9 3WGT FAD 1.98676
10 3HQP OXL 1.98676
11 2DVZ GLU 1.98676
12 5NCB JZ3 1.98676
13 1FWV SGA MAG FUC 2.23881
14 5XH2 NPO 2.29008
15 3DRW AMP 2.31788
16 3CQD ATP 2.31788
17 1UA4 AMP 2.31788
18 2X1L ADN 2.31788
19 1QMG DMV 2.31788
20 2ZRU FMN 2.31788
21 5OD2 5ID 2.64901
22 5WS9 OXL 2.64901
23 2P3V SRT 2.73438
24 2PHF MAN MAN BMA MAN 2.77778
25 2PHR MAN MAN BMA MAN 2.77778
26 1Q8P MAN MMA 2.77778
27 2PHF MAN MAN 2.77778
28 1Z0S ATP 2.8777
29 3KO0 TFP 2.9703
30 5VZ0 2BA 2.98013
31 5E58 CPZ 2.98013
32 5CX6 CDP 2.98013
33 1SUW NAP 3.21285
34 1JA9 PYQ 3.28467
35 2WPB ZZI 3.31126
36 3WG3 A2G GAL NAG FUC 3.37079
37 3ZJX BOG 3.80623
38 1A8S PPI 4.0293
39 2R0H CTO 4.26829
40 4XF6 INS 4.3956
41 4XF6 LIP 4.3956
42 4XF6 ADP 4.3956
43 1GNI OLA 4.63576
44 3C3N FMN 4.63576
45 4C5N PXL 4.71014
46 4C5N ACP 4.71014
47 2AWN ADP 5.29801
48 1FX8 BOG 5.33808
49 1KNM LAT 5.38462
50 5GVR LMR 5.55556
51 4RYV ZEA 5.80645
52 5LWY OLB 5.88235
53 1XVB BHL 5.88235
54 2R4J 13P 5.96026
55 2R4J FAD 5.96026
56 6H45 QEI 6.29139
57 3ZS7 ATP 6.33333
58 6FA4 D1W 6.35838
59 2ALG DAO 6.52174
60 5O2J 2PO 6.59341
61 5O0J 8BR 6.62252
62 5O3Q CMP 6.66667
63 3NBC LAT 6.75676
64 6BT4 KPM 6.93069
65 4Z24 FAD 6.95364
66 5L2R MLA 7.28477
67 4EN4 ATP 7.28477
68 4EN4 GT1 7.28477
69 4EN4 GT0 7.28477
70 1LNX URI 8.64198
71 5C9J DAO 9.09091
72 1HBK COA 10.1124
73 3QH2 3NM 10.8597
74 1SBR VIB 13.5
75 2F6U CIT 14.1026
76 2VAR AMP 14.2384
77 2VAR ANP 14.2384
78 2W5P CL8 18.1208
79 2JGV ADP 19.2053
80 2JG1 ANP 19.2053
81 3LOO B4P 20.8609
82 3OTX AP5 23.1788
83 2ABS ACP 23.5099
84 2D7I NGA 25.8278
85 4MNS 2AX 29.5597
86 2HW1 ANP 40.2685
87 4XDA ADP 41.0596
88 4XDA RIB 41.0596
89 3NC9 TR3 41.3907
90 4PVV HO4 41.7219
91 1RKD ADP 43.0464
92 1RKD RIB 43.0464
Pocket No.: 3; Query (leader) PDB : 2C49; Ligand: ADN; Similar sites found with APoc: 62
This union binding pocket(no: 3) in the query (biounit: 2c49.bio1) has 15 residues
No: Leader PDB Ligand Sequence Similarity
1 1KYZ SAH 1.3245
2 1KYZ FER 1.3245
3 5T2U NAP 1.6129
4 5QIN J2V 1.65563
5 1B8U NAD 2.12766
6 1B8U OAA 2.12766
7 1EU1 MGD 2.31788
8 3CQD ATP 2.31788
9 5L9O GOP 2.61194
10 2CVQ NDP 2.64901
11 3MI2 PFU 2.86738
12 1DMR PGD 2.98013
13 2CDC XYP 2.98013
14 2CDC NAP 2.98013
15 2CDC XYS 2.98013
16 3NJ4 NAD 2.98013
17 4RGQ 13P 2.98013
18 5MDH NAD 3.31126
19 4MDH NAD 3.31126
20 1EU8 TRE 3.31126
21 5WP5 SAH 3.31126
22 1T9D FAD 3.64238
23 5WKC FAD 3.64238
24 1R37 NAD 3.64238
25 5V4R MGT 3.7037
26 1DQX BMP 3.74532
27 2AE2 NAP 3.84615
28 2AE2 PTO 3.84615
29 3EWC MCF 3.97351
30 4GKV NAD 4.30464
31 4ZSY RW2 4.63576
32 4A6D SAM 4.63576
33 4GA6 AMP 4.63576
34 2QZX IVA VAL VAL STA ALA STA 4.63576
35 5TOW ADN 5.29801
36 5TOW NAI 5.29801
37 5WYF ILP 5.29801
38 4XV1 904 5.47945
39 1GQ2 NAP 5.96026
40 3CV2 OXL 6.29139
41 3FQ8 PMP 6.29139
42 6FU4 HSM 6.29139
43 1P7T PYR 6.62252
44 1YQD NAP 6.62252
45 1X1Z BMP 7.14286
46 5DDW 5B6 7.61589
47 2PTR 2SA 7.94702
48 1V8B NAD 8.60927
49 4LA7 A1O 8.80829
50 1MAI I3P 9.16031
51 2GVC FAD 9.27152
52 5FI3 NAP 9.60265
53 5A1T NAI 9.67742
54 5A1T OXM 9.67742
55 2A4W BLM 12.3188
56 3ZEI AWH 13.5484
57 5ZCO CHD 13.5593
58 3WSJ MK1 15.5172
59 1IDA 0PO 16.1616
60 5NUF NAD 17.7711
61 5NUE NAD 17.7711
62 2NVA PL2 18.543
Pocket No.: 4; Query (leader) PDB : 2C49; Ligand: ANP; Similar sites found with APoc: 33
This union binding pocket(no: 4) in the query (biounit: 2c49.bio1) has 23 residues
No: Leader PDB Ligand Sequence Similarity
1 5Y02 HBX None
2 5AHN IMP 1.98676
3 3CTY FAD 1.98676
4 3PA8 621 2.3622
5 1UPR 4IP 2.43902
6 2G2Y MLI 2.98013
7 1C1X HFA 3.31126
8 1Q9I TEO 3.31126
9 1Q9I FAD 3.31126
10 3AI3 SOL 3.42205
11 2AK3 AMP 3.53982
12 3HP9 CF1 3.64238
13 3R75 PYR 3.97351
14 2CIX CEJ 4.01338
15 5C9P FUC 4.30464
16 3BY9 SIN 4.61538
17 3KP6 SAL 4.63576
18 5FPE 3TR 4.96689
19 3E3U NVC 5.07614
20 4UCC ZKW 5.15021
21 1GUX ASP LEU TYR CYS TYR GLU GLN LEU ASN 5.26316
22 6CED EYA 5.60748
23 2DTJ THR 5.61798
24 3AB4 THR 5.61798
25 2ZL4 ALA ALA ALA ALA 6.63265
26 5D85 FLC 6.95364
27 1ME8 RVP 8.54871
28 2GAG NAD 10.101
29 5Z84 CHD 13.5593
30 5W97 CHD 13.5593
31 5ZCO CHD 13.5593
32 2OG7 AHB 13.9073
33 4F4S EFO 17.1053
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