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Receptor
PDB id Resolution Class Description Source Keywords
5C9J 2.4 Å NON-ENZYME: OTHER HUMAN CD1C WITH LIGANDS IN A' AND F' CHANNEL HOMO SAPIENS ANTIGEN PRESENTATION CD1 HUMAN CD1 MHC-LIKE IMMUNOLOGY ANTIGEN IMMUNE SYSTEM
Ref.: CHOLESTERYL ESTERS STABILIZE HUMAN CD1C CONFORMATIO RECOGNITION BY SELF-REACTIVE T CELLS. PROC.NATL.ACAD.SCI.USA V. 113 E1266 2016
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
DAO A:301;
A:302;
Valid;
Valid;
none;
none;
submit data
200.318 C12 H24 O2 CCCCC...
PO4 A:308;
A:307;
Invalid;
Invalid;
none;
none;
submit data
94.971 O4 P [O-]P...
GOL A:304;
B:101;
A:305;
A:306;
Invalid;
Invalid;
Invalid;
Invalid;
none;
none;
none;
none;
submit data
92.094 C3 H8 O3 C(C(C...
STE A:303;
Valid;
none;
submit data
284.477 C18 H36 O2 CCCCC...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
5C9J 2.4 Å NON-ENZYME: OTHER HUMAN CD1C WITH LIGANDS IN A' AND F' CHANNEL HOMO SAPIENS ANTIGEN PRESENTATION CD1 HUMAN CD1 MHC-LIKE IMMUNOLOGY ANTIGEN IMMUNE SYSTEM
Ref.: CHOLESTERYL ESTERS STABILIZE HUMAN CD1C CONFORMATIO RECOGNITION BY SELF-REACTIVE T CELLS. PROC.NATL.ACAD.SCI.USA V. 113 E1266 2016
Members (1)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1443 families.
1 5C9J - STE C18 H36 O2 CCCCCCCCCC....
70% Homology Family (8)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 62 families.
1 5WKE - P50 C40 H76 N O9 P CCCCCCCCCC....
2 1GZQ - PII C42 H81 O13 P CCCCCCCCCC....
3 5L2J - 70E C42 H82 O8 CCCCCCCCCC....
4 5WL1 - D3D C40 H77 O10 P CCCCCCCCCC....
5 5WKG - CUY C42 H84 O2 CCCCCCCCCC....
6 2H26 - 6UL C40 H80 O2 CCCCCCCCCC....
7 5C9J - STE C18 H36 O2 CCCCCCCCCC....
8 3L9R - L9Q C41 H80 N O8 P CCCCCCCCCC....
50% Homology Family (33)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 42 families.
1 5WKE - P50 C40 H76 N O9 P CCCCCCCCCC....
2 1GZQ - PII C42 H81 O13 P CCCCCCCCCC....
3 5L2J - 70E C42 H82 O8 CCCCCCCCCC....
4 5WL1 - D3D C40 H77 O10 P CCCCCCCCCC....
5 5WKG - CUY C42 H84 O2 CCCCCCCCCC....
6 2H26 - 6UL C40 H80 O2 CCCCCCCCCC....
7 3GMM - PLM C16 H32 O2 CCCCCCCCCC....
8 3G08 Kd = 6.843 nM FEE C39 H77 N O9 CCCCCCCCCC....
9 3MA7 - CD4 C65 H126 O17 P2 CCCCCCCCCC....
10 1Z5L - PBS C32 H63 N O9 CCCCCCCCCC....
11 5TW5 - PLM C16 H32 O2 CCCCCCCCCC....
12 3ILQ Kd = 6.2 uM 1O2 C43 H80 O10 CCCCCCCCCC....
13 3GMR - PLM C16 H32 O2 CCCCCCCCCC....
14 3T1F - 3TF C43 H80 O10 CCCCCCCCCC....
15 3GMQ - PLM C16 H32 O2 CCCCCCCCCC....
16 6BMH - F61 C35 H69 N O9 CCCCCCCCCC....
17 2AKR - CIS C48 H91 N O11 S CCCCCCCCCC....
18 3GMP - PBS C32 H63 N O9 CCCCCCCCCC....
19 3AU1 - ERA BGC GAL n/a n/a
20 3GMN - PLM C16 H32 O2 CCCCCCCCCC....
21 5TW2 - 7LP C34 H58 N2 O10 CCCCCCCC(=....
22 3GML - PLM C16 H32 O2 CCCCCCCCCC....
23 2Q7Y - IGC C44 H81 N O18 CCCCCCCCCC....
24 6BMK - F57 C31 H61 O8 P CCCCCCCCCC....
25 3ILP - 1L2 C45 H80 O10 CCCCCCCC/C....
26 3GMO - PLM C16 H32 O2 CCCCCCCCCC....
27 2FIK - PLM C16 H32 O2 CCCCCCCCCC....
28 1ONQ - SLF C42 H81 N O11 S CCCCCCCCCC....
29 4X6E - 42H C26 H53 N O7 P CCCCCCCC/C....
30 4X6F - 3XU C47 H94 N2 O6 P CCCCCCCCCC....
31 4F7E - 0SH C40 H79 N O9 CCCCCCCCCC....
32 5C9J - STE C18 H36 O2 CCCCCCCCCC....
33 3L9R - L9Q C41 H80 N O8 P CCCCCCCCCC....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: DAO; Similar ligands found: 62
No: Ligand ECFP6 Tc MDL keys Tc
1 MYR 1 1
2 EW8 1 1
3 TDA 1 1
4 F15 1 1
5 PLM 1 1
6 STE 1 1
7 X90 1 1
8 DAO 1 1
9 KNA 1 1
10 DCR 1 1
11 F23 1 1
12 11A 1 1
13 DKA 1 1
14 OCA 0.956522 1
15 SHV 0.833333 0.952381
16 KTC 0.793103 0.875
17 AZ1 0.73913 0.64
18 6NA 0.72 0.904762
19 ELA 0.71875 0.954545
20 OLA 0.71875 0.954545
21 NER 0.71875 0.954545
22 VCA 0.666667 0.954545
23 PAM 0.666667 0.954545
24 PML 0.625 0.6
25 3LA 0.606061 0.8
26 LEA 0.6 0.809524
27 MYZ 0.588235 0.909091
28 12H 0.586207 0.615385
29 ODD 0.567568 0.913043
30 BRC 0.566667 0.666667
31 14V 0.555556 0.740741
32 M12 0.545455 0.869565
33 14U 0.542857 0.703704
34 EIC 0.538462 0.913043
35 EOD 0.538462 0.7
36 D0G 0.5 0.954545
37 BMJ 0.5 0.954545
38 BNV 0.5 0.954545
39 BUA 0.48 0.666667
40 RCL 0.468085 0.84
41 FTT 0.459459 0.807692
42 HXD 0.459459 0.807692
43 56S 0.459459 0.653846
44 ODT 0.452381 0.782609
45 3X1 0.444444 0.818182
46 LNL 0.44186 0.826087
47 9J6 0.441176 0.666667
48 OOA 0.441176 0.76
49 CUY 0.435897 0.68
50 6UL 0.435897 0.68
51 CNS 0.435897 0.68
52 5UF 0.432432 0.807692
53 243 0.428571 0.807692
54 1QW 0.418605 0.606061
55 GYM 0.418605 0.606061
56 O8N 0.413793 0.75
57 1DO 0.413793 0.75
58 PL3 0.413793 0.75
59 OC9 0.413793 0.75
60 DE1 0.413793 0.75
61 F09 0.413793 0.75
62 T25 0.403846 0.677419
Ligand no: 2; Ligand: STE; Similar ligands found: 62
No: Ligand ECFP6 Tc MDL keys Tc
1 MYR 1 1
2 EW8 1 1
3 TDA 1 1
4 F15 1 1
5 PLM 1 1
6 STE 1 1
7 X90 1 1
8 DAO 1 1
9 KNA 1 1
10 DCR 1 1
11 F23 1 1
12 11A 1 1
13 DKA 1 1
14 OCA 0.956522 1
15 SHV 0.833333 0.952381
16 KTC 0.793103 0.875
17 AZ1 0.73913 0.64
18 6NA 0.72 0.904762
19 ELA 0.71875 0.954545
20 OLA 0.71875 0.954545
21 NER 0.71875 0.954545
22 VCA 0.666667 0.954545
23 PAM 0.666667 0.954545
24 PML 0.625 0.6
25 3LA 0.606061 0.8
26 LEA 0.6 0.809524
27 MYZ 0.588235 0.909091
28 12H 0.586207 0.615385
29 ODD 0.567568 0.913043
30 BRC 0.566667 0.666667
31 14V 0.555556 0.740741
32 M12 0.545455 0.869565
33 14U 0.542857 0.703704
34 EIC 0.538462 0.913043
35 EOD 0.538462 0.7
36 D0G 0.5 0.954545
37 BMJ 0.5 0.954545
38 BNV 0.5 0.954545
39 BUA 0.48 0.666667
40 RCL 0.468085 0.84
41 FTT 0.459459 0.807692
42 HXD 0.459459 0.807692
43 56S 0.459459 0.653846
44 ODT 0.452381 0.782609
45 3X1 0.444444 0.818182
46 LNL 0.44186 0.826087
47 9J6 0.441176 0.666667
48 OOA 0.441176 0.76
49 CUY 0.435897 0.68
50 6UL 0.435897 0.68
51 CNS 0.435897 0.68
52 5UF 0.432432 0.807692
53 243 0.428571 0.807692
54 1QW 0.418605 0.606061
55 GYM 0.418605 0.606061
56 O8N 0.413793 0.75
57 1DO 0.413793 0.75
58 PL3 0.413793 0.75
59 OC9 0.413793 0.75
60 DE1 0.413793 0.75
61 F09 0.413793 0.75
62 T25 0.403846 0.677419
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 5C9J; Ligand: STE; Similar sites found with APoc: 198
This union binding pocket(no: 1) in the query (biounit: 5c9j.bio1) has 22 residues
No: Leader PDB Ligand Sequence Similarity
1 4WG0 CHD None
2 1UO4 PIH None
3 1UO5 PIH None
4 1L5Y BEF None
5 6GNO XDI None
6 1OGZ EQU 1.6
7 4F4P 0SB 1.8315
8 4WGF HX2 2.43902
9 2CDO GAL AAL GAL AAL GAL AAL 2.5
10 3FS1 ALA ALA LEU ALA ALA LEU LEU ALA ALA 2.6087
11 5U83 ZN8 3.30189
12 4RW3 TDA 3.31126
13 4UMJ BFQ 3.55872
14 4HK8 XYP XYP XYP XYP XYP XYP 3.7037
15 5A89 FMN 3.84615
16 5A89 ADP 3.84615
17 1OW4 2AN 3.87597
18 5AIG VPR 4
19 3WG3 A2G GAL NAG FUC 4.0404
20 5UNJ RJW 4.0404
21 4M73 M72 4.0404
22 4M73 SAH 4.0404
23 1YOK P6L 4.0404
24 1JAY F42 4.0404
25 4B7P 9UN 4.0404
26 4FFG 0U8 4.0404
27 4X8D AVI 4.25056
28 5X80 SAL 4.375
29 1HBK COA 4.49438
30 5HWV MBN 4.61538
31 2JDR L20 4.62633
32 2JDR GLY ARG PRO ARG THR THR SER PHE ALA GLU 4.62633
33 1NP7 FAD 4.62633
34 3KP6 SAL 4.63576
35 4K10 NI9 5.05051
36 1SR7 MOF 5.05051
37 3ZXE PGZ 5.26316
38 2QES ADE 5.36398
39 3RWP ABQ 5.69395
40 4ITH RCM 5.69395
41 1SDW IYT 6.06061
42 1RL4 BL5 6.06061
43 5XJ7 87O 6.06061
44 3BJC WAN 6.06061
45 2XMY CDK 6.06061
46 5Y72 DST 6.06061
47 6FXR AKG 6.06061
48 4J24 EST 6.06061
49 5OLK DTP 6.06061
50 2IYG FMN 6.45161
51 1YUC EPH 6.66667
52 4MRP GSH 7.07071
53 5KJW 53C 7.07071
54 5EW9 5VC 7.07071
55 1YRX FMN 7.07071
56 5DQ8 FLF 7.07071
57 5NTP 98E 7.07071
58 5CX6 CDP 7.07071
59 2VGD XYP XYP 7.07071
60 3V8S 0HD 7.07071
61 3CBC DBS 7.07071
62 5EOB 5QQ 7.07071
63 5L7G LYS SER LEU LEU GLN GLN LEU LEU THR GLU 7.07071
64 1YFS ALA 7.07071
65 2OG7 SIN 7.47331
66 1MID LAP 7.69231
67 1JGS SAL 7.97101
68 5Y4R C2E 8.08081
69 6CB2 OLC 8.08081
70 5XLY C2E 8.08081
71 1XX4 BAM 8.08081
72 3B9Z CO2 8.08081
73 1UDY CS8 8.08081
74 2ATJ BHO 8.08081
75 4URL XAM 8.08081
76 4LIT AKG 8.08081
77 1UDY FAD 8.08081
78 1M13 HYF 8.08081
79 4RD0 GDP 8.08081
80 1QNF HDF 8.08081
81 1QNF FAD 8.08081
82 4QBK 3NZ 8.24742
83 2XG5 EC5 8.67052
84 2XG5 EC2 8.67052
85 6B04 C6J 8.8968
86 2BCG GER 9.09091
87 2BHW NEX 9.09091
88 2NUN ADP 9.09091
89 3LN0 52B 9.09091
90 5ICE 2H4 9.09091
91 1XVB BHL 9.41177
92 1FK5 OLA 9.67742
93 6CGN DA 9.96441
94 4DXJ 0M9 9.96441
95 1ZPD CIT 9.96441
96 5GLT BGC GAL NAG GAL 9.96441
97 1YHM AHD 9.96441
98 3ZPG 5GP 9.96441
99 3H0L ADP 9.96441
100 4O4Z N2O 10.101
101 4XCP PLM 10.101
102 5M36 9SZ 10.101
103 4NAE 1GP 10.101
104 4URN NOV 10.101
105 5M37 9SZ 10.101
106 2Q8G AZX 10.101
107 2C3Q GTX 10.101
108 5H9P TD2 10.1266
109 2GBB CIT 10.2564
110 1NU4 MLA 10.3093
111 4RLT FSE 10.7595
112 4DE3 DN8 11.0266
113 4DE2 DN3 11.0266
114 1I0B PEL 11.1111
115 5C1M 4VO 11.1111
116 4YMU ARG 11.1111
117 4MG9 27K 11.1111
118 3N7S 3N7 11.1111
119 2W3L DRO 11.1111
120 2XK9 XK9 11.1111
121 4TV1 36M 11.1111
122 5C1M CLR 11.1111
123 5AAV GW5 11.1111
124 4MGA 27L 11.1111
125 4WOE ADP 11.1111
126 2BSA NAP 11.1111
127 1QCI ADE 11.1111
128 2VN9 GVD 11.1111
129 3SAO NKN 11.1111
130 1XMY ROL 11.1111
131 5C1M OLC 11.1111
132 1WUB OTP 11.236
133 2D5X L35 11.6438
134 2CIX CEJ 12.1212
135 1ULE GLA GAL NAG 12.1212
136 2YVE MBT 12.1212
137 6BVK EAV 12.1212
138 6BVM EBV 12.1212
139 4PJT 2YQ 12.1212
140 6BVJ EAS 12.1212
141 6D5L FW7 12.1212
142 6D5M FW4 12.1212
143 6BVL EBY 12.1212
144 6BVI EC4 12.1212
145 6D5J FV4 12.1212
146 6D59 FVJ 12.1212
147 2QL9 CIT 12.3711
148 4B6C B5U 12.7551
149 3W5N RAM 12.8114
150 3KYQ DPV 13.0653
151 5AZC PGT 13.1313
152 3I27 SID 13.1313
153 5UKL SIX 13.1313
154 5CHR 4NC 13.1387
155 2YAK OSV 13.879
156 3MG9 GHP 3MY 3FG GHP GHP OMY 3FG 14.1414
157 1Y0G 8PP 14.1414
158 3WYJ H78 14.1414
159 2C3W GLC GLC GLC GLC 14.1414
160 3TL1 JRO 14.4654
161 4URX FK1 14.5946
162 3RMK BML 15.1515
163 1XZ3 ICF 15.1515
164 4YUS FMN 15.1515
165 2QJY UQ2 15.1515
166 3THR C2F 15.1515
167 1DTL BEP 15.528
168 4Y24 TD2 15.5844
169 1TV5 N8E 16.1616
170 2ET1 GLV 16.1616
171 5Z84 CHD 16.9492
172 5W97 CHD 16.9492
173 5ZCO CHD 16.9492
174 3V1S 0LH 17.1717
175 3OYW TDG 17.9104
176 5LX9 OLB 18.1818
177 3GUZ PAF 18.1818
178 6BMM OLB 18.1818
179 1ZED PNP 18.1818
180 3D9F N6C 18.1818
181 3D9F FAD 18.1818
182 3VRV YSD 18.1818
183 2Y69 CHD 18.5714
184 5X3R 7Y3 19.1919
185 2QCX PF1 22.2222
186 1TO9 HMH 22.2222
187 5UC9 MYR 22.2222
188 2HZL PYR 22.2222
189 2VMG MBG 23.2323
190 4OGQ 7PH 23.5294
191 4OGQ UMQ 23.5294
192 1T0S BML 24.4186
193 1ZEI CRS 24.5283
194 5W7B MYR 26.2626
195 2YKL NLD 28.2828
196 5OCA 9QZ 28.2828
197 2UW1 GVM 32.3232
198 5LWY OLB 33.6134
Pocket No.: 2; Query (leader) PDB : 5C9J; Ligand: DAO; Similar sites found with APoc: 652
This union binding pocket(no: 2) in the query (biounit: 5c9j.bio1) has 12 residues
No: Leader PDB Ligand Sequence Similarity
1 2ZFZ ARG None
2 4NKW PLO 2.0202
3 3P9T TCL 2.0202
4 1C1X HFA 2.0202
5 1BW9 PPY 2.0202
6 1LRI CLR 2.04082
7 2ZCQ B65 2.13523
8 5V3Y 5V8 2.13523
9 3E7O 35F 2.13523
10 1UVC STE 2.1978
11 5UR6 8KM 2.20994
12 5DLY 5D7 2.25564
13 1R6N 434 2.36967
14 4WGF HX2 2.43902
15 4IS0 1R4 2.48963
16 1TMX HGX 2.4911
17 1PZL MYR 2.53165
18 3FS1 MYR 2.6087
19 4Q4K FMN 2.84698
20 4K26 SFF 2.89855
21 6GL8 F3Q 2.90698
22 6EVN PRO PRO GLY PRO ALA GLY PRO PRO GLY 2.94118
23 4BNU 9KQ 2.97398
24 2E2R 2OH 3.0303
25 4EKQ NPO 3.0303
26 4D3S BOG 3.0303
27 4ZEI LAO 3.0303
28 2GWH PCI 3.20285
29 5KZD RCJ 3.20285
30 4D7M TDC 3.22581
31 2X32 OTP 3.35196
32 3PVT 3HC 3.55872
33 2Q6B HR2 3.55872
34 2GSU AMP 3.55872
35 3MBG FAD 3.59712
36 3M6P BB2 3.62694
37 1OGX EQU 3.81679
38 4POJ 2VP 3.8961
39 4M8E 29V 3.8961
40 5XWV 8H6 3.91459
41 3O55 FAD 4
42 4P5E N6P 4.0404
43 1YOK P6L 4.0404
44 1XRO LEU 4.0404
45 4B7P 9UN 4.0404
46 1ZDU P3A 4.0404
47 5G3N X28 4.0404
48 3JRS A8S 4.0404
49 4M73 SAH 4.0404
50 4M73 M72 4.0404
51 4J6C STR 4.0404
52 5CC2 CKA 4.0404
53 3KFL ME8 4.0404
54 3G6N MET ALA SER 4.0404
55 2P1C GG3 4.0404
56 5OD2 5ID 4.0404
57 1G27 BB1 4.0404
58 5HTL C2E 4.13793
59 5J6A P46 4.27046
60 1NHZ 486 4.28571
61 5DUF G7A 4.56274
62 2O5L MNR 4.57516
63 1NTV ASN PHE ASP ASN PRO VAL TYR ARG LYS THR 4.60526
64 3HB5 E2B 4.62633
65 3HB5 NAP 4.62633
66 4NV7 COA 4.62633
67 1NP7 FAD 4.62633
68 3KP6 SAL 4.63576
69 1M2Z DEX 4.66926
70 1M2Z BOG 4.66926
71 3BQD DAY 4.70588
72 3ANP DCC 4.90196
73 6BTN E8M 4.9505
74 3LLI FAD 4.98084
75 5A8E XTK 4.98221
76 3E70 GDP 4.98221
77 3V49 PK0 5.05051
78 1SR7 MOF 5.05051
79 2AX9 BHM 5.05051
80 4OAR 2S0 5.05051
81 3WCA FPS 5.05051
82 3ETG NDP 5.05051
83 3ETG GLU 5.05051
84 3ETG GTP 5.05051
85 1QV1 CZH 5.05051
86 5B0I BOG 5.05051
87 4IMG NGF 5.05051
88 4I9A NCN 5.05051
89 2YOO K2B 5.05051
90 4U0S ADP 5.05051
91 4JZX 476 5.05051
92 3LDW ZOL 5.05051
93 3FZG SAM 5.05051
94 2ZFU SAH 5.11628
95 3GWN FAD 5.26316
96 4F4S EFO 5.26316
97 2WPB ZZI 5.33808
98 5HCN DAO 5.36398
99 3OU2 SAH 5.50459
100 1C9K 5GP 5.55556
101 5LU5 M7P 5.58376
102 2JBZ COA 5.59441
103 3CQD ATP 5.69395
104 6A0S NDP 5.69395
105 4INW 1EY 5.71429
106 5JF2 SF7 5.88235
107 4WKI 3PW 5.95745
108 4I4B NAD 6.04982
109 4I4B 1CV 6.04982
110 2FDW D3G 6.04982
111 2I0G I0G 6.06061
112 3GZ9 D32 6.06061
113 2A3I C0R 6.06061
114 2YJD YJD 6.06061
115 5OLK DTP 6.06061
116 4DOO DAO 6.06061
117 1YP0 PEF 6.06061
118 4O1Z MXM 6.06061
119 5XJ7 87O 6.06061
120 6FQZ 6PG 6.06061
121 4NAT ADP 6.06061
122 5MWY YNU 6.06061
123 4QWT ACD 6.06061
124 5X8Q 82R 6.06061
125 2EVL GAL SPH EIC 6.06061
126 6CHP F0Y 6.06061
127 1RL4 BL5 6.06061
128 2WH8 II2 6.06061
129 5HCV 60R 6.06061
130 3ND6 ATP 6.06061
131 1YMT DR9 6.06061
132 3EM0 CHD 6.06061
133 5MBC FMN 6.06061
134 5LOF 70R 6.06061
135 1R5L VIV 6.06061
136 4QJR PIZ 6.06061
137 5V13 JH3 6.06061
138 1YKD CMP 6.06061
139 5NTW 98N 6.06061
140 1KPG 16A 6.06061
141 2OKL BB2 6.06061
142 2V51 ATP 6.06061
143 5KOK R9T 6.06061
144 4B1W ATP 6.06061
145 3EBL GA4 6.06061
146 4V24 GYR 6.06061
147 4QOM PYG 6.06061
148 4B1V LAB 6.06061
149 4B1V ATP 6.06061
150 1RL4 BRR 6.06061
151 4XYM A12 6.06061
152 4B1X ATP 6.06061
153 1ZDT PEF 6.06061
154 2UXI G50 6.19048
155 3U5S FAD 6.34921
156 1LOX RS7 6.40569
157 5B4B LP5 6.45161
158 1DQE BOM 6.56934
159 3GWL FAD 6.60377
160 5WIU AQD 6.63507
161 4P6X HCY 6.66667
162 1YUC EPH 6.66667
163 2HI4 BHF 6.76157
164 3ICS COA 6.76157
165 3ICT COA 6.76157
166 1Q1Y BB2 6.80628
167 6BYM HC3 7.07071
168 1S17 GNR 7.07071
169 2AMV BIN 7.07071
170 1LN1 DLP 7.07071
171 5L7G 6QE 7.07071
172 1N1G BCP 7.07071
173 4UDB CV7 7.07071
174 2FV5 541 7.07071
175 5NTP 98E 7.07071
176 6C1R EFD 7.07071
177 1OLM VTQ 7.07071
178 4UWJ MYA 7.07071
179 4UWJ 7L5 7.07071
180 5TO8 7FM 7.07071
181 6MPT C30 7.07071
182 3EE4 MYR 7.07071
183 1J0D 5PA 7.07071
184 5CX6 CDP 7.07071
185 5DRB 5FJ 7.07071
186 6ESN BWE 7.07071
187 5APK 76E 7.07071
188 1FCH TYR GLN SER LYS LEU 7.07071
189 3UMV FAD 7.07071
190 1KPH 10A 7.07071
191 5IXK 6EW 7.07071
192 1YRX FMN 7.07071
193 4EI7 GDP 7.07071
194 5OBY ANP 7.07071
195 5NI5 8YB 7.07071
196 2I0K FAD 7.07071
197 4UA3 COA 7.07071
198 4HY1 19X 7.07071
199 4WZV E40 7.07071
200 6IIU A8X 7.07071
201 6CAY ERG 7.10059
202 5HCY 60D 7.11744
203 4F97 GDP 7.11744
204 3QKD HI0 7.18232
205 3NBK PNS 7.34463
206 5YEE ATP 7.35294
207 4EOX 0S5 7.38916
208 1LVK MNT BEF 7.47331
209 5CYV WCA 7.53425
210 5U1M ACE LEU TYR ALA SER SER ASN PRO ALA PTR 7.61905
211 1MID LAP 7.69231
212 3C56 PH4 7.82918
213 2HHP FLC 7.82918
214 3MN5 ATP 7.89474
215 3OGN 3OG 8.06452
216 3H0A D30 8.08081
217 3G9E RO7 8.08081
218 4IGH ORO 8.08081
219 4IGH FMN 8.08081
220 4IGH 1EA 8.08081
221 3B1M KRC 8.08081
222 1FM9 570 8.08081
223 1RDT 570 8.08081
224 4E2J MOF 8.08081
225 5TWO 7MV 8.08081
226 5UFS 1TA 8.08081
227 4HEE 14R 8.08081
228 3GN8 DEX 8.08081
229 2XFH CL6 8.08081
230 6BQC LOP 8.08081
231 3W54 RNB 8.08081
232 3KC1 2T6 8.08081
233 1M13 HYF 8.08081
234 3V66 D3A 8.08081
235 5UWA 8ND 8.08081
236 2P4Y C03 8.08081
237 4WZ8 3W7 8.08081
238 4KCF AKM 8.08081
239 3RDE OYP 8.08081
240 3KMZ EQO 8.08081
241 1DKF BMS 8.08081
242 3ET3 ET1 8.08081
243 2PEH LYS ARG LYS SER ARG TRP ASP GLU THR PRO 8.08081
244 1DKF OLA 8.08081
245 3FUR Z12 8.08081
246 4KX8 L2O VAL VAL ASP 8.08081
247 1FM9 9CR 8.08081
248 2WUF KEM 8.08081
249 4URL XAM 8.08081
250 6CB2 OLC 8.08081
251 2BHZ MAL 8.08081
252 1N4H REA 8.08081
253 1RDT L79 8.08081
254 5BQI GSH 8.08081
255 5BQI 4UL 8.08081
256 3BW2 FMN 8.08081
257 3H0A 9RA 8.08081
258 3RO7 TDR 8.08081
259 3I53 SAH 8.08081
260 1XAJ CRB 8.08081
261 6FX0 E9T 8.08081
262 5A86 D7E 8.08081
263 3ROE THM 8.08081
264 5X93 K87 8.08081
265 2IYA ZIO 8.08081
266 3Q2H QHF 8.08081
267 3T03 3T0 8.08081
268 4DM8 REA 8.08081
269 4PIV NDP 8.08081
270 1F7L COA 8.08081
271 1FCZ 156 8.08081
272 1JGT APC 8.08081
273 4COL DTP 8.18505
274 2PX6 DH9 8.18505
275 4QBK 3NZ 8.24742
276 3N7O N7O 8.40708
277 4F0B GDS 8.48214
278 2X5W K2B 8.54093
279 2OWZ CIT 8.54093
280 1JR8 FAD 8.54701
281 2JEV NHQ 8.62069
282 5W10 CMP 8.71795
283 3D04 SAK 8.80503
284 3WDM ADN 8.81226
285 1BGQ RDC 8.88889
286 2OBF F83 8.8968
287 3GAY P6T 8.8968
288 3OJI PYV 8.99471
289 4RC8 STE 9.00901
290 3LN0 52B 9.09091
291 3E3U NVC 9.09091
292 5LPA ATP 9.09091
293 5LPA 71R 9.09091
294 5IKR ID8 9.09091
295 1T27 PCW 9.09091
296 4A2B AGS 9.09091
297 4PGK Y69 9.09091
298 5ICE 2H4 9.09091
299 5ICE SAH 9.09091
300 4BUY F37 9.09091
301 3CGD NAD 9.09091
302 3CGD FAD 9.09091
303 3CGD COA 9.09091
304 4A2A ATP 9.09091
305 2BCG GER 9.09091
306 6BMS PLM 9.09091
307 2QHD DAO 9.09091
308 5FUS DAO 9.09091
309 2C49 ANP 9.09091
310 2BHW NEX 9.09091
311 4IA6 EIC 9.09091
312 3QCJ NX4 9.09091
313 4U63 FAD 9.09091
314 2CI0 1CM 9.09091
315 1JNQ EGT 9.09091
316 2BIF BOG 9.09091
317 3HP9 CF1 9.09091
318 1Q7E MET 9.09091
319 5ZZB ATP 9.09091
320 3UXL CFI 9.09091
321 5Y24 GLY MET PRO ARG GLY ALA 9.25267
322 3L1N PLM 9.27835
323 1XVB BHL 9.41177
324 1XVB 3BR 9.41177
325 3WR7 COA 9.41177
326 2HJ3 FAD 9.6
327 1UUO ORO 9.60854
328 1UUO FMN 9.60854
329 1FK5 OLA 9.67742
330 5XK9 DMA 9.91379
331 5XK9 GST 9.91379
332 2Z7I 742 9.96441
333 2RH1 CAU 9.96441
334 2RH1 CLR 9.96441
335 5EEH SAH 9.96441
336 5EEH P9P 9.96441
337 1ZPD CIT 9.96441
338 4DXJ 0M9 9.96441
339 5C2H 4PX 10.101
340 5K52 OCD 10.101
341 2W90 6PG 10.101
342 3ABA FLI 10.101
343 4BXK 1IU 10.101
344 6G5J EM8 10.101
345 2J07 HDF 10.101
346 2J07 FAD 10.101
347 5OWC AYZ 10.101
348 2GMH UQ5 10.101
349 1ECM TSA 10.101
350 3QCP FAD 10.101
351 1SBR VIB 10.101
352 4CDN FO1 10.101
353 4CDN FAD 10.101
354 4YC9 4C1 10.101
355 1FP1 HCC 10.101
356 3HR1 PF9 10.101
357 5M36 9SZ 10.101
358 5M37 9SZ 10.101
359 1UBY DMA 10.101
360 1LVL FAD 10.101
361 3GYT DL4 10.101
362 2C43 COA 10.101
363 1WS1 BB2 10.101
364 2C3Q GTX 10.101
365 6DIO NAD 10.101
366 1WK9 TSB 10.101
367 6GKV F2W 10.101
368 4WQ2 3SU 10.101
369 3FAL REA 10.1504
370 3FAL LO2 10.1504
371 1GHE ACO 10.1695
372 2FP2 TSA 10.241
373 2GBB CIT 10.2564
374 1NU4 MLA 10.3093
375 4W97 UCA 10.5
376 1OPK MYR 10.6762
377 4RLT FSE 10.7595
378 5DMZ ADP 11.032
379 4TWP AXI 11.0701
380 2QE4 JJ3 11.1111
381 5AAV GW5 11.1111
382 4MGB XDH 11.1111
383 5K53 STE 11.1111
384 2BJ4 OHT 11.1111
385 3G4G D71 11.1111
386 5OHJ 9VE 11.1111
387 3G58 988 11.1111
388 5C1M OLC 11.1111
389 1XON PIL 11.1111
390 4CA5 3EF 11.1111
391 5W7U GY8 11.1111
392 1XM4 PIL 11.1111
393 2Q2Y ADP 11.1111
394 2Q2Y MKR 11.1111
395 2YB9 HA0 11.1111
396 2EW5 Y12 11.1111
397 3GWT 066 11.1111
398 1XMU ROF 11.1111
399 4TMN 0PK 11.1111
400 1XMY ROL 11.1111
401 1UHK CZN 11.1111
402 4TV1 36M 11.1111
403 2HFN FMN 11.1111
404 5D9J 0N8 11.1111
405 3N7S 3N7 11.1111
406 3HBV ALA LYS ALA SER GLN ALA ALA 11.1111
407 4HBM 0Y7 11.1111
408 1RKD ADP 11.1111
409 1RKD RIB 11.1111
410 3AAQ ARU 11.1111
411 4WT2 3UD 11.1111
412 6F8B CXH 11.1111
413 4TUZ 36J 11.1111
414 1RX0 2MC 11.1111
415 5DX3 EST 11.1111
416 5C1M 4VO 11.1111
417 2J83 BAT 11.1111
418 1I0B PEL 11.1111
419 3C2O NTM 11.1111
420 4MGA 27L 11.1111
421 2VAR ANP 11.1111
422 5BV6 35G 11.1842
423 1WUB OTP 11.236
424 4LSJ LSJ 11.2403
425 6GAS FAD 11.3879
426 4OAS 2SW 11.4583
427 6AYI C3G 11.5578
428 1RV1 IMZ 11.7647
429 5Z1N PEF 11.9048
430 5XET ME8 12.0996
431 2D5Z L35 12.1212
432 4MIB 28M 12.1212
433 5LGA 6VH 12.1212
434 4YV5 SVR 12.1212
435 4XDA ADP 12.1212
436 5YWX 93C 12.1212
437 5YWX GSH 12.1212
438 2WSA 646 12.1212
439 2WSA MYA 12.1212
440 3VHZ L2P GLC MAN SGA 12.1212
441 4O4K 2PK 12.1212
442 4IV9 FAD 12.1212
443 2VJ8 HA2 12.1212
444 6B3A SAM 12.1212
445 4IVG ANP 12.1212
446 2A06 SMA 12.1212
447 5HM3 649 12.1212
448 4BTB PRO PRO PRO PRO PRO PRO PRO PRO PRO 12.1212
449 4PJT 2YQ 12.1212
450 4RQL SNE 12.1212
451 4JE7 BB2 12.1212
452 6BVK EAV 12.1212
453 6BVM EBV 12.1212
454 5UGW GSH 12.5714
455 5UC1 486 12.6126
456 4B6C B5U 12.7551
457 3SFI 3SF 13.1313
458 1LQY BB2 13.1313
459 5EK3 5PK 13.1313
460 4ZW3 4S9 13.1313
461 1DMH LIO 13.1313
462 6C7D EOJ 13.1313
463 5AZC PGT 13.1313
464 4YSX E23 13.1313
465 5CXI 5TW 13.1313
466 4BS0 6NT 13.1313
467 3AFN NAP 13.1313
468 2XG9 NOJ GLC 13.1313
469 5DEQ ARA 13.1313
470 2V1O COA 13.1313
471 5CHR 4NC 13.1387
472 4ZVI 4S4 13.1673
473 3R1V AZB 13.3858
474 1L6O SER LEU LYS LEU MET THR THR VAL 13.6842
475 3RET SAL 13.8614
476 3RET PYR 13.8614
477 3TGE TGE 13.879
478 5K0S 0OU 13.879
479 1H9G COA MYR 13.9918
480 3WYJ H78 14.1414
481 6F6E PLM 14.1414
482 3JRX S1A 14.1414
483 2H7C COA 14.1414
484 4M4Q 21A 14.1414
485 3NMV PYV 14.1414
486 3COW 52H 14.1414
487 2X24 X24 14.1414
488 3AJH BL3 14.1414
489 1Y0G 8PP 14.1414
490 2ZKJ ADP 14.1414
491 3TL1 JRO 14.4654
492 2HW2 RFP 14.6853
493 5KOR GDP 14.9466
494 3F8C HT1 15.0794
495 5W7D PX8 15.1515
496 2WPX ACO 15.1515
497 3X1M COA 15.1515
498 1ZOA 140 15.1515
499 4LA7 A1O 15.1515
500 4B52 RDF 15.1515
501 2YNE YNE 15.1515
502 2YNE NHW 15.1515
503 2YNC YNC 15.1515
504 3NT6 COA 15.1515
505 4H6Q TFB 15.1515
506 3NTA COA 15.1515
507 4NE2 SH2 15.1515
508 5JO1 6LM 15.1515
509 3RMK BML 15.1515
510 2QJY SMA 15.1515
511 4DS8 A8S 15.1515
512 3F5K CE5 15.1515
513 1ESM COA 15.1515
514 5TDU PCR 15.1515
515 2VAT COA 15.1515
516 4IBF 1D5 15.1515
517 1ISI NCA 15.1515
518 5GMH RX8 15.1515
519 4IPE ANP 15.1515
520 2EV1 OLA 15.1515
521 4YUS FMN 15.1515
522 3D78 NBB 15.9664
523 4S15 4D8 16.0156
524 5K7K 6RJ 16.1616
525 4ORM ORO 16.1616
526 4ORM FMN 16.1616
527 4ORM 2V6 16.1616
528 5K7H IVC 16.1616
529 3I51 6PL 16.1616
530 5MU6 MYA 16.1616
531 5MU6 KFK 16.1616
532 3G5K BB2 16.1616
533 1XW6 GSH 16.1616
534 3EWC MCF 16.1616
535 1U3D FAD 16.1616
536 2YPO PHE 16.1616
537 4H03 ATP 16.1616
538 4PKI ATP 16.1616
539 4ZGM 32M 16.3934
540 3GF2 SAL 16.4384
541 3OKI OKI 16.7382
542 2DYS TGL 16.9492
543 2DYS PGV 16.9492
544 5ZCO PGV 16.9492
545 5Z84 PGV 16.9492
546 5ZCO TGL 16.9492
547 2DYR PEK 16.9492
548 2DYS PEK 16.9492
549 5Z84 TGL 16.9492
550 2DYR TGL 16.9492
551 2DYR PGV 16.9492
552 5Z84 CHD 16.9492
553 5W97 CHD 16.9492
554 2DYS PSC 16.9492
555 5ZCO PEK 16.9492
556 5ZCO PSC 16.9492
557 5Z84 PEK 16.9492
558 5ZCO CHD 16.9492
559 5Z84 PSC 16.9492
560 1EM6 CP4 17.1717
561 5U97 PIT 17.1717
562 5N9T 8QQ 17.1717
563 1W96 S1A 17.1717
564 4UX9 ANP 17.1717
565 4DR9 BB2 17.1717
566 4DV8 0LX 17.1717
567 1Q2C COA 17.1717
568 3CB2 GDP 17.1717
569 2XSU PIE 18.1818
570 1OQC FAD 18.1818
571 5LX9 OLB 18.1818
572 5IM3 DTP 18.1818
573 4Q86 AMP 18.1818
574 3KFC 61X 18.1818
575 2PRG BRL 18.1818
576 1K7L 544 18.1818
577 1IYK MYA 18.1818
578 5LX9 OLA 18.1818
579 5G57 6M5 18.1818
580 3NTD COA 18.1818
581 2C0U FAD NBT 18.1818
582 3T31 DCQ 18.1818
583 1PZO CBT 18.1818
584 5EHR 5OD 18.1818
585 1MGP PLM 18.1818
586 6C8R EQV 18.1818
587 1VPV PLM 18.1818
588 4U9W COA 18.1818
589 2Y69 CHD 18.5714
590 3KDU NKS 19.1919
591 5F1R 42O 19.1919
592 3T58 FAD 19.1919
593 2NPA MMB 19.1919
594 2Q1H AS4 19.1919
595 2P54 735 19.1919
596 3FEI CTM 19.1919
597 3ET1 ET1 19.1919
598 5A4W QCT 19.1919
599 2Q0D ATP 19.1919
600 1N8V BDD 19.6429
601 1IID NHM 20.202
602 5N5U 7N8 20.202
603 3HKW IX6 20.202
604 3JDW ORN 20.202
605 3AB1 FAD 20.202
606 3DWB RDF 20.202
607 1ATL 0QI 20.202
608 2ZXG S23 20.202
609 2NNQ T4B 20.6107
610 2HFP NSI 21.2121
611 2E9L OLA 21.2121
612 2R40 EPH 21.2121
613 3CXH SMA 22.2222
614 2IBZ UQ6 22.2222
615 1EZV SMA 22.2222
616 5UC9 MYR 22.2222
617 3CX5 SMA 22.2222
618 5EY0 GTP 22.2222
619 2IBZ SMA 22.2222
620 5U3B 7TD 22.2222
621 4DJA FAD 23.2323
622 4DJA DLZ 23.2323
623 4OGQ 2WA 23.5294
624 4OGQ 7PH 23.5294
625 5AB0 2X0 7GA LYS HIS HIS ALA PHE SER PHE LYN 24.2424
626 1N6B DMZ 24.2424
627 1T0S BML 24.4186
628 1X0P FAD 25.2525
629 4N14 WR7 25.2525
630 2BNE U5P 25.2525
631 5W7B MYR 26.2626
632 2GJ3 FAD 26.2626
633 3KRO IPE 26.2626
634 3KRO DST 26.2626
635 4OIV XX9 28.2828
636 5OCA 9QZ 28.2828
637 6A5Y 9CR 28.2828
638 3BEJ MUF 28.2828
639 5IKH 6BW 28.2828
640 5HZ9 5M8 28.2828
641 4H07 IPH 29.2208
642 1OUK 084 30.303
643 2EIX FAD 30.303
644 5LJ0 6XX 30.7692
645 3I59 N6R 31.3131
646 4Q9M FPP 32.3232
647 4Q9M 2ZW 32.3232
648 5LWY OLB 33.6134
649 5LWY OLA 33.6134
650 3FWN ATR 34.3434
651 3FWN 6PG 34.3434
652 2IZ1 RES 35.3535
Pocket No.: 3; Query (leader) PDB : 5C9J; Ligand: DAO; Similar sites found with APoc: 38
This union binding pocket(no: 3) in the query (biounit: 5c9j.bio1) has 16 residues
No: Leader PDB Ligand Sequence Similarity
1 1OAA OAA 4.0404
2 3KV4 OGA 4.62633
3 3N9O OGA 4.98221
4 1QY1 PRZ 6.06061
5 2XMY CDK 6.06061
6 6EOZ AKG 6.06061
7 5HV0 AKG 6.06061
8 2IYG FMN 6.45161
9 1HG4 LPP 7.07071
10 2WLG SOP 7.07071
11 2O07 MTA 7.07071
12 2O07 SPD 7.07071
13 2Z77 NCA 7.91367
14 3QVV A3P 8.08081
15 3QVV 3QV 8.08081
16 5KVM THR TYR PHE ALA VAL LEU MET VAL SER 8.42105
17 2PT9 2MH 8.54093
18 4NG2 OHN 8.84956
19 6AMI TRP 9.09091
20 1TW4 CHD 9.09091
21 5TFZ 7BC 10.101
22 4KWD JF2 10.101
23 2Q8G AZX 10.101
24 4MG9 27K 11.1111
25 3SAO NKN 11.1111
26 2IID PHE 12.1212
27 2IID FAD 12.1212
28 5E7V M7E 12.1212
29 1ZB6 GST 12.1212
30 4C2X NHW 13.1313
31 3PQB VGP 14.1414
32 2R68 SUP 14.1414
33 1I7M PUT 14.9254
34 1J78 VDY 15.1515
35 3FRH SAH 17.1717
36 3SP6 IL2 19.1919
37 2R40 20E 21.2121
38 2GJ5 VD3 34.3434
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