Receptor
PDB id Resolution Class Description Source Keywords
2HEK 2 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF O67745, A HYPOTHETICAL PROTEIN FROM AQU AEOLICUS AT 2.0 A RESOLUTION. AQUIFEX AEOLICUS PREDOMINANTLY ALPHA HELICAL PROTEIN WITH GDP BINDING SITE ANSITE BEING FAR FROM EACH OTHER STRUCTURAL GENOMICS PSI PSTRUCTURE INITIATIVE BERKELEY STRUCTURAL GENOMICS CENTER UNKNOWN FUNCTION
Ref.: STRUCTURE OF O67745_AQUAE, A HYPOTHETICAL PROTEIN F AQUIFEX AEOLICUS. ACTA CRYSTALLOGR.,SECT.F V. 63 369 2007
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
BR B:603;
Invalid;
none;
submit data
79.904 Br [Br-]
CL A:604;
A:606;
B:605;
B:607;
B:608;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
submit data
35.453 Cl [Cl-]
GDP A:401;
A:402;
Valid;
Valid;
none;
none;
submit data
443.201 C10 H15 N5 O11 P2 c1nc2...
GOL A:403;
A:404;
A:406;
A:407;
A:408;
A:410;
B:405;
B:409;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
PO4 A:501;
B:502;
B:503;
B:504;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
94.971 O4 P [O-]P...
ZN A:602;
B:601;
Part of Protein;
Part of Protein;
none;
none;
submit data
65.409 Zn [Zn+2...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
2HEK 2 Å NON-ENZYME: OTHER CRYSTAL STRUCTURE OF O67745, A HYPOTHETICAL PROTEIN FROM AQU AEOLICUS AT 2.0 A RESOLUTION. AQUIFEX AEOLICUS PREDOMINANTLY ALPHA HELICAL PROTEIN WITH GDP BINDING SITE ANSITE BEING FAR FROM EACH OTHER STRUCTURAL GENOMICS PSI PSTRUCTURE INITIATIVE BERKELEY STRUCTURAL GENOMICS CENTER UNKNOWN FUNCTION
Ref.: STRUCTURE OF O67745_AQUAE, A HYPOTHETICAL PROTEIN F AQUIFEX AEOLICUS. ACTA CRYSTALLOGR.,SECT.F V. 63 369 2007
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1256 families.
1 2HEK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
70% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1068 families.
1 2HEK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
50% Homology Family (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 922 families.
1 2HEK - GDP C10 H15 N5 O11 P2 c1nc2c(n1[....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: GDP; Similar ligands found: 153
No: Ligand ECFP6 Tc MDL keys Tc
1 GDP 1 1
2 GTP 0.909091 1
3 GP3 0.881579 0.973684
4 GNH 0.858974 0.986667
5 GNP 0.839506 0.973684
6 G 0.828947 0.986486
7 5GP 0.828947 0.986486
8 G1R 0.82716 0.986667
9 GCP 0.82716 0.973684
10 GSP 0.817073 0.948718
11 GAV 0.797619 0.961039
12 GMV 0.792683 0.973684
13 G2P 0.77381 0.961039
14 G2R 0.770115 0.961039
15 GDP MG 0.759036 0.923077
16 GP2 0.756098 0.961039
17 GDP BEF 0.75 0.9
18 GDD 0.747253 0.961039
19 GKE 0.747253 0.961039
20 GDC 0.747253 0.961039
21 GPG 0.741573 0.961039
22 G3D 0.732558 0.986486
23 ALF 5GP 0.729412 0.888889
24 Y9Z 0.728261 0.902439
25 GTP MG 0.724138 0.923077
26 BEF GDP 0.724138 0.888889
27 G5P 0.723404 0.973684
28 GFB 0.72043 0.961039
29 GTG 0.72043 0.936709
30 GDR 0.72043 0.961039
31 G4P 0.715909 0.986486
32 GCP G 0.715909 0.935065
33 6CK 0.712766 0.936709
34 G3A 0.712766 0.973684
35 GDP ALF 0.7 0.888889
36 GDP AF3 0.7 0.888889
37 YGP 0.698925 0.901235
38 JB2 0.697917 0.961039
39 GKD 0.697917 0.961039
40 GDX 0.690722 0.973684
41 GPD 0.690722 0.925
42 GMP 0.684211 0.88
43 0O2 0.666667 0.986486
44 G G 0.659574 0.935065
45 JB3 0.656863 0.948718
46 NGD 0.650485 0.961039
47 GDP 7MG 0.636364 0.911392
48 DGI 0.636364 0.923077
49 U2G 0.634615 0.936709
50 GPX 0.634409 0.946667
51 IDP 0.632184 0.972973
52 2MD 0.632075 0.891566
53 CAG 0.62963 0.880952
54 CG2 0.622642 0.936709
55 FEG 0.619048 0.879518
56 MGD 0.614679 0.891566
57 ZGP 0.613208 0.869048
58 GH3 0.612903 0.973333
59 3GP 0.611765 0.946667
60 MD1 0.607143 0.891566
61 PGD 0.59292 0.925
62 DGT 0.591398 0.923077
63 BGO 0.588785 0.924051
64 TPG 0.582609 0.840909
65 DBG 0.582609 0.948718
66 2GP 0.574713 0.96
67 FE9 0.570175 0.776596
68 I2C FE2 CMO CMO 0.566372 0.808989
69 G A A A 0.553571 0.923077
70 MGP 0.553191 0.961039
71 U A G G 0.548673 0.935065
72 G4M 0.548387 0.880952
73 6G0 0.547368 0.961039
74 G1R G1R 0.542373 0.924051
75 P2G 0.527473 0.883117
76 PGD O 0.525 0.850575
77 ADP 0.522222 0.92
78 GGM 0.517544 0.901235
79 DG 0.516484 0.910256
80 DGP 0.516484 0.910256
81 P1G 0.516129 0.871795
82 G G U 0.509259 0.935065
83 G1G 0.508475 0.925
84 IMP 0.505495 0.959459
85 G C 0.504348 0.9
86 GPC 0.491525 0.879518
87 G7M 0.483871 0.948052
88 6AD 0.479592 0.841463
89 ATP 0.473684 0.92
90 G2Q 0.471154 0.961039
91 U G A 0.469697 0.888889
92 5FA 0.46875 0.92
93 AQP 0.46875 0.92
94 GTA 0.468468 0.936709
95 7DD 0.468085 0.906667
96 G G G RPC 0.466102 0.875
97 SGP 0.463158 0.82716
98 01G 0.462963 0.902439
99 B4P 0.457447 0.894737
100 AP5 0.457447 0.894737
101 A2D 0.456522 0.894737
102 G G G C 0.455285 0.9125
103 ACQ 0.454545 0.896104
104 5GP 5GP 0.454545 0.883117
105 ANP 0.454545 0.896104
106 A G C C 0.451613 0.911392
107 APC G U 0.45082 0.886076
108 G U34 0.449153 0.888889
109 DG DG 0.448598 0.865854
110 ITT 0.447917 0.868421
111 BA3 0.446809 0.894737
112 35G 0.444444 0.933333
113 C2E 0.444444 0.921053
114 PCG 0.444444 0.933333
115 MGO 0.441176 0.864198
116 AN2 0.4375 0.907895
117 G C C C 0.4375 0.924051
118 M33 0.43299 0.883117
119 UCG 0.429688 0.911392
120 A G U 0.42963 0.888889
121 ACP 0.428571 0.896104
122 MGQ 0.424528 0.935897
123 7DT 0.424242 0.906667
124 APR 0.424242 0.894737
125 AR6 0.424242 0.894737
126 93A 0.42268 0.833333
127 A4P 0.420168 0.869048
128 SAP 0.42 0.873418
129 AD9 0.42 0.896104
130 AGS 0.42 0.873418
131 G8D 0.42 0.875
132 CA0 0.418367 0.896104
133 ATF 0.417476 0.884615
134 AGO 0.414634 0.888889
135 NIA 0.413043 0.82716
136 MGV 0.412844 0.890244
137 TAT 0.411765 0.884615
138 A1R 0.411215 0.839506
139 ADQ 0.411215 0.871795
140 RGT 0.410714 0.909091
141 CGP 0.409836 0.86747
142 AMP 0.408602 0.893333
143 A 0.408602 0.893333
144 UP5 0.40678 0.873418
145 C2R 0.406593 0.906667
146 AMZ 0.406593 0.918919
147 JBT 0.405882 0.778947
148 A22 0.40566 0.907895
149 25L 0.405405 0.907895
150 ADX 0.40404 0.809524
151 8OD 0.401961 0.946667
152 4TC 0.4 0.851852
153 50T 0.4 0.883117
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 2HEK; Ligand: GDP; Similar sites found: 289
This union binding pocket(no: 1) in the query (biounit: 2hek.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1BTN I3P 0.002747 0.46845 None
2 2F01 BTQ 0.01267 0.43057 None
3 1Y2W NAG 0.006606 0.40869 None
4 1UW1 ADP 0.005081 0.4077 None
5 1D09 PAL 0.008783 0.45443 0.967742
6 1QF5 GDP 0.02862 0.40451 1.07817
7 1QF5 RPL 0.02862 0.40451 1.07817
8 3NFZ 3NF 0.001972 0.40094 1.22324
9 1P9B IMO 0.008615 0.40313 1.34771
10 4LHM AZZ 0.001069 0.43564 1.61725
11 1FP1 HCC 0.001069 0.42987 1.61725
12 1ZED PNP 0.007602 0.41216 1.61725
13 1SOW NAD 0.01022 0.40949 1.82927
14 1NW5 SAM 0.004606 0.40716 1.88088
15 3ZGE ASP 0.00002428 0.53441 1.88679
16 1OLS TDP 0.001697 0.45535 1.88679
17 1Z45 GAL 0.0002568 0.45387 1.88679
18 2XVE FAD 0.008721 0.43598 1.88679
19 3F3E LEU 0.005023 0.42806 1.88679
20 4C2G ALA ALA ALA ALA 0.001256 0.42057 1.88679
21 2YVF NAD 0.02496 0.41536 1.88679
22 2YVF FAD 0.02419 0.41536 1.88679
23 2AMV BIN 0.02278 0.4104 1.88679
24 3GE7 AFQ 0.01217 0.40749 1.88679
25 2DKH 3HB 0.01712 0.40743 1.88679
26 2DKH FAD 0.01221 0.40743 1.88679
27 1UBY DMA 0.002759 0.41182 1.90736
28 1SQ5 PAU 0.004126 0.40587 1.94805
29 5EQU AKG 0.006642 0.42155 1.96721
30 1H8G CHT 0.0005455 0.5047 2.10526
31 4NAO AKG 0.002519 0.43352 2.14724
32 2Q8H TF4 0.0004952 0.48358 2.15633
33 2YIV NBN 0.0007235 0.45762 2.15633
34 2YIV YIV 0.005853 0.4241 2.15633
35 4CMF PXG 0.003759 0.44482 2.17391
36 3IL6 B83 0.001876 0.42241 2.18069
37 1C0I FAD 0.02236 0.40766 2.20386
38 1C0I BE2 0.02236 0.40766 2.20386
39 1U7Z PMT 0.01134 0.40877 2.21239
40 1PL6 572 0.009801 0.41141 2.24719
41 2GDZ NAD 0.01262 0.40326 2.24719
42 1PL6 NAD 0.008438 0.40032 2.24719
43 1UXG NAD 0.001995 0.44613 2.26537
44 1UXG FUM 0.001995 0.44613 2.26537
45 2DTX BMA 0.016 0.40869 2.27273
46 2QIA U20 0.02128 0.41353 2.29008
47 1P72 THM 0.004471 0.40448 2.39521
48 3WE0 FAD 0.001759 0.4537 2.42588
49 1TIW TFB 0.003112 0.43794 2.42588
50 1TIW FAD 0.003112 0.43794 2.42588
51 4O8A 2OP 0.009282 0.42199 2.42588
52 4M51 BEZ 0.007695 0.41858 2.42588
53 1GJW GLC 0.005939 0.41694 2.42588
54 1XOC VAL ASP SER LYS ASN THR SER SER TRP 0.01634 0.40923 2.42588
55 4LIT AKG 0.00731 0.40117 2.42588
56 2NLI FMN 0.02502 0.41278 2.44565
57 2GJ3 FAD 0.01545 0.40024 2.5
58 1LTH NAD 0.0148 0.42017 2.50784
59 2HFK E4H 0.00384 0.40712 2.50784
60 3GWT 066 0.005063 0.42088 2.54958
61 1XX4 BAM 0.0009933 0.46897 2.68199
62 3CXO 3LR 0.003802 0.42333 2.69542
63 3LIH RAF 0.002067 0.41876 2.69542
64 3O2K DST 0.002 0.4184 2.69542
65 2YYJ FAD 0.03887 0.41506 2.69542
66 2YYJ 4HP 0.03887 0.41506 2.69542
67 2QS8 MET 0.01046 0.40263 2.69542
68 3CXO 1N5 0.01564 0.40062 2.69542
69 1B8U OAA 0.007002 0.4163 2.73556
70 1B8U NAD 0.005332 0.40649 2.73556
71 1YOE RIB 0.002182 0.40006 2.79503
72 4COQ SAN 0.002632 0.42581 2.83401
73 2B82 ADN 0.0008788 0.43729 2.8436
74 3VPD ANP 0.000931 0.4363 2.84698
75 4W6Z ETF 0.004139 0.43899 2.88184
76 1T8U A3P 0.002585 0.41697 2.94118
77 3ZPG 5GP 0.004323 0.43807 2.96496
78 2Q09 DI6 0.001913 0.41354 2.96496
79 2QJN KDG 0.001047 0.40571 2.96496
80 1PEA ACM 0.01463 0.4056 2.96496
81 4G1V FAD 0.01099 0.40313 2.96496
82 1I0Z OXM 0.0103 0.41979 3.003
83 3PFG SAM 0.008309 0.42183 3.04183
84 3PFG TLO 0.008309 0.42183 3.04183
85 1XIU REA 0.0002203 0.41169 3.04348
86 4DQ2 BTX 0.0006483 0.45471 3.04878
87 4AF5 CIT 0.006153 0.41001 3.15789
88 1V7R CIT 0.029 0.40477 3.22581
89 1Q3Q ANP 0.005807 0.44113 3.2345
90 1F8F NAD 0.04425 0.4003 3.2345
91 2HVW DCP 0.004001 0.40123 3.26087
92 1C3V PDC 0.007301 0.4012 3.26531
93 3CEV ARG 0.003204 0.40492 3.34448
94 2CSN CKI 0.001382 0.43663 3.367
95 4B16 NAG 0.02425 0.40876 3.38346
96 2J8Z NAP 0.009578 0.40691 3.38983
97 2XK9 XK9 0.01383 0.40628 3.41615
98 3UEC ALA ARG TPO LYS 0.005898 0.41707 3.42466
99 1O9U ADZ 0.003115 0.44496 3.42857
100 1GSA ADP 0.001028 0.43651 3.48101
101 1GSA GSH 0.01648 0.41 3.48101
102 4GYW UDP 0.0007616 0.45621 3.50404
103 4KCF AKM 0.002386 0.4238 3.50404
104 1HSJ GLC 0.01977 0.42156 3.50404
105 1KOL NAD 0.006918 0.42111 3.50404
106 4KCF FMN 0.002339 0.41239 3.50404
107 4QVH FLC 0.0423 0.40537 3.50404
108 1KTC NGA 0.005075 0.40229 3.50404
109 1DSS NAD 0.0102 0.40166 3.6036
110 3WUD GLC GAL 0.008775 0.41593 3.67647
111 3D3W NAP 0.01585 0.40268 3.68852
112 2PT9 2MH 0.005266 0.42384 3.73832
113 2PT9 S4M 0.007697 0.4066 3.73832
114 1L1Q 9DA 0.005755 0.40338 3.76344
115 1VJT NAD 0.00291 0.41496 3.77358
116 2GSD NAD 0.01338 0.40796 3.77358
117 2XDQ MGX 0.02043 0.40531 3.77358
118 1XVV CCQ 0.0235 0.40153 3.77358
119 4PO2 ASN ARG LEU LEU LEU THR GLY 0.00857 0.40322 3.82979
120 2PWY SAH 0.006151 0.40742 3.87597
121 1WRA PC 0.007581 0.41221 3.8961
122 1SS4 CIT 0.0004424 0.51446 3.92157
123 2HGZ PBF 0.0008574 0.44327 3.92157
124 1SS4 GSH 0.01556 0.42477 3.92157
125 2VQ5 LDP 0.01164 0.4172 3.9801
126 4B9E FAH 0.007257 0.41306 3.98671
127 2Q3M MLA 0.008694 0.42337 3.98773
128 2WQP WQP 0.01028 0.40296 4.01146
129 3PJU C2E 0.007843 0.40772 4.01606
130 3TKA CTN 0.0009541 0.51296 4.03458
131 4IOK ADP 0.002974 0.42478 4.04313
132 1X54 4AD 0.005563 0.41075 4.04313
133 2BZ1 TAU 0.00165 0.47912 4.08163
134 2JFV FLC 0.01029 0.40043 4.12371
135 1NN5 ANP 0.006629 0.41477 4.18605
136 1NN5 2DT 0.006629 0.41477 4.18605
137 3VHZ L2P GLC MAN SGA 0.04498 0.40627 4.19847
138 3VHZ SOG 0.04378 0.40424 4.19847
139 3NOJ PYR 0.006564 0.40042 4.20168
140 2OWZ CIT 0.003709 0.41943 4.21687
141 2Q8M AMP 0.001335 0.40633 4.21687
142 3BY8 MLT 0.001608 0.4422 4.22535
143 2OFD NGA 0.009713 0.4015 4.22535
144 1Y75 NAG 0.003033 0.40584 4.23729
145 3CBG SAH 0.00444 0.40386 4.31034
146 3L24 GOA 0.0007756 0.47416 4.31267
147 4IVG ANP 0.01782 0.41511 4.31267
148 1R27 MGD 0.01209 0.41087 4.31267
149 3HY3 10F 0.004634 0.41232 4.4335
150 9LDT OXM 0.006825 0.43681 4.51807
151 9LDB NAD 0.01104 0.40689 4.51807
152 2W8Q SIN 0.00599 0.41677 4.58221
153 4C0C WVH 0.02733 0.40303 4.58221
154 1H8P PC 0.002488 0.44968 4.58716
155 5YAS FAC 0.00219 0.40609 4.66926
156 3Q3C NAD 0.03974 0.40106 4.68227
157 2YBQ SAH 0.002328 0.41875 4.79452
158 2YBQ UP2 0.01091 0.41276 4.79452
159 4RJK PYR 0.0005598 0.47133 4.85175
160 1RYI GOA 0.002899 0.47016 4.85175
161 1NVU GTP 0.006405 0.43776 4.85175
162 2ZJ3 G6P 0.002849 0.41532 4.85175
163 1I1Q TRP 0.002207 0.41115 4.85175
164 3MAG 3MA 0.005446 0.44179 4.88599
165 4G28 0W8 0.001794 0.41461 4.90196
166 2QCX PF1 0.007575 0.40053 4.94297
167 2X61 CH 0.005243 0.42937 5.03876
168 2X61 NGA GAL SIA 0.04448 0.40149 5.03876
169 1A69 FMB 0.0334 0.40962 5.04202
170 3MCT 3MC 0.001774 0.42047 5.05051
171 2OFV 242 0.02365 0.41264 5.05415
172 1JGS SAL 0.0009935 0.49085 5.07246
173 1JA9 PYQ 0.01009 0.40598 5.10949
174 2Q1A 2KT 0.001113 0.44181 5.11945
175 4B7E OGA 0.001569 0.42876 5.15759
176 3P3N AKG 0.00801 0.40509 5.15759
177 2P41 SAH 0.004031 0.4075 5.2459
178 1EDO NAP 0.03123 0.4144 5.32787
179 2C31 TZD 0.003083 0.46216 5.39084
180 2C31 ADP 0.002989 0.46216 5.39084
181 3WO0 ADP 0.002448 0.44011 5.39084
182 3WO0 ALA 0.002448 0.44011 5.39084
183 2IMP NAI 0.04812 0.40975 5.39084
184 5FIT AP2 0.0008901 0.42339 5.44218
185 1GAD NAD 0.002523 0.42767 5.45455
186 3L6R MLI 0.009936 0.40697 5.49133
187 4K30 NLG 0.005777 0.40004 5.625
188 4Q0A 4OA 0.0001723 0.40769 5.62914
189 3OIG NAD 0.04152 0.40409 5.6391
190 2F2U M77 0.00018 0.44646 5.66038
191 1TDF FAD 0.01229 0.41983 5.6962
192 1TDF NAP 0.02739 0.41812 5.6962
193 2BLE 5GP 0.04678 0.40173 5.72207
194 1FDJ 2FP 0.001954 0.41056 5.78512
195 1F7L COA 0.01859 0.40033 5.78512
196 3TO7 COA 0.01446 0.41229 5.7971
197 1Z42 HBA 0.00236 0.47036 5.91716
198 1Z44 NPO 0.04408 0.40275 5.91716
199 4CCO OGA 0.001447 0.42399 5.92992
200 1Y1A GSH 0.0005253 0.506 6.01093
201 3U4C NDP 0.008886 0.40824 6.04982
202 2YC5 6BC 0.001576 0.44695 6.14035
203 4NES UD1 0.002346 0.41662 6.19946
204 3TXO 07U 0.003597 0.40298 6.23229
205 3QDY CBS 0.002908 0.43075 6.29371
206 3P0K FAD 0.00295 0.41841 6.39098
207 1YAG ATP 0.001448 0.43244 6.4
208 1ECM TSA 0.001743 0.41509 6.42202
209 1KBJ FMN 0.002695 0.42496 6.469
210 3S2Y FMN 0.0006455 0.43836 6.53266
211 1FIQ MTE 0.004402 0.42209 6.57143
212 1FIQ FAD 0.006609 0.41971 6.57143
213 1FIQ SAL 0.006206 0.41848 6.57143
214 1ULE GLA GAL NAG 0.002149 0.44427 6.66667
215 2V7T SAH 0.01203 0.44179 6.68896
216 4OYA 1VE 0.01072 0.44777 6.73854
217 1H16 PYR 0.002877 0.4384 6.73854
218 3RFV NAI 0.009316 0.40607 6.74157
219 3H86 AP5 0.01345 0.41771 6.77083
220 1OAA OAA 0.004052 0.43809 6.94981
221 1ZJ6 G3D 0.001634 0.40288 6.95187
222 2BO4 FLC 0.002111 0.43694 7.00809
223 3I0O ADP 0.0005466 0.42852 7.07965
224 3I0O SMI 0.003639 0.41369 7.07965
225 3C1O NAP 0.01027 0.40007 7.16511
226 3OZG SSI 0.003171 0.40733 7.2
227 3N5O GSH 0.002819 0.41353 7.23404
228 3Q9T FAY 0.01115 0.41441 7.27763
229 1V35 NAI 0.00543 0.43071 7.29483
230 4BAS GNP 0.004051 0.41119 7.53769
231 2ZWS PLM 0.0004492 0.50919 7.54717
232 1WGC SIA GAL BGC 0.005405 0.44195 7.60234
233 1NF8 BOG 0.007897 0.41142 7.72947
234 1TOI HCI 0.004775 0.41928 7.81671
235 2OI2 DP6 0.003454 0.40126 7.87671
236 1A8R GTP 0.005874 0.40303 8.1448
237 4CCN OGA 0.001119 0.44171 8.57143
238 1R37 NAD 0.001441 0.44734 8.64553
239 1UWZ THU 0.001935 0.41554 8.82353
240 3I6B KDO 0.005535 0.40079 8.88889
241 3BLI ACO 0.00335 0.41622 8.90208
242 1VDC FAD 0.003983 0.44202 9.00901
243 4IS0 1R4 0.008583 0.40003 9.12863
244 4C0X FMN 0.007143 0.40936 9.35961
245 3LZW NAP 0.004881 0.44521 9.93976
246 1CL2 PPG 0.002633 0.41666 9.97305
247 3V1U NAD 0.007573 0.40688 9.97305
248 1SC3 MLI 0.002622 0.44027 10.2273
249 2XI7 XI7 0.01834 0.42331 10.3261
250 3PNL ADP 0.0008772 0.43924 10.6443
251 2WE5 ADP 0.001847 0.41396 10.6452
252 1DLJ UGA 0.002773 0.45061 10.9453
253 1DLJ NAI 0.01461 0.41891 10.9453
254 4KQI RBZ 0.001717 0.44026 10.9551
255 4KQI NIO 0.001717 0.44026 10.9551
256 2D0V PQQ 0.001863 0.42253 11.1111
257 2EB5 OXL 0.00713 0.40726 11.236
258 4LSJ LSJ 0.002352 0.42048 11.2403
259 3R35 4CO 0.006922 0.41528 11.2583
260 2C7G FAD 0.02612 0.41127 11.3208
261 1ZGA SAH 0.001179 0.42135 11.4846
262 1ZGA HMK 0.002631 0.4057 11.4846
263 1UO4 PIH 0.0151 0.41927 11.7647
264 2V5E SCR 0.02347 0.40948 11.8812
265 4JCA CIT 0.02839 0.40525 11.976
266 1JIL 485 0.003276 0.41295 12.1294
267 3ZRR PXG 0.004869 0.40622 12.3989
268 3GM5 CIT 0.01015 0.40068 12.5786
269 1JAC AMG 0.002149 0.46226 12.782
270 1VR0 3SL 0.001507 0.40571 13.3603
271 4GQB 0XU 0.009286 0.42912 13.3721
272 1SAZ ACP 0.04193 0.41159 13.7466
273 2HMT NAI 0.02504 0.40707 13.8889
274 1T0S BML 0.0005216 0.47275 13.9535
275 3MBG FAD 0.003819 0.41887 14.3885
276 2QDT I38 0.002442 0.41167 15.2416
277 4TMK T5A 0.02742 0.43187 15.493
278 4BMO FMN 0.0022 0.42851 15.9664
279 2W3L DRO 0.02525 0.40081 15.9722
280 3U5S FAD 0.0046 0.40902 16.6667
281 1JUV NDP 0.004033 0.41942 17.0984
282 1H2M OGA 0.007481 0.40637 17.3077
283 1NU4 MLA 0.03127 0.41083 18.5567
284 1H2K OGA 0.00636 0.40939 21.9512
285 1PTR PRB 0.003231 0.42871 26
286 1UO5 PIH 0.01353 0.43039 26.4706
287 1OGD RIP 0.003405 0.40919 27.4809
288 4MZ7 DGT 0.0000000000008555 0.52896 37.1968
289 4MZ7 DTP 0.000000000001017 0.52755 37.1968
Pocket No.: 2; Query (leader) PDB : 2HEK; Ligand: GDP; Similar sites found: No similar binding sites found, or similarity not calculated due to duplicate pocket.
This union binding pocket(no: 2) in the query (biounit: 2hek.bio1) has 16 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
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