Found one PDB record: 5GUF
No: |
PDB id |
Binding Data |
Representative ligand |
Formula |
Smiles |
The Class containing this family consists of a total of 337 families.
|
1
|
6U1V
|
- |
FDA
|
C27 H35 N9 O15 P2
|
Cc1cc2c(cc....
|
No: |
PDB id |
Binding Data |
Representative ligand |
Formula |
Smiles |
The Class containing this family consists of a total of 225 families.
|
1
|
6U1V
|
- |
FDA
|
C27 H35 N9 O15 P2
|
Cc1cc2c(cc....
|
No: |
Ligand |
ECFP6 Tc |
MDL keys Tc
|
1
|
FDA
|
1
|
1
|
2
|
FNK
|
0.691781
|
0.965517
|
3
|
F2N
|
0.647436
|
0.976744
|
4
|
FAD
|
0.641892
|
0.906977
|
5
|
FAS
|
0.641892
|
0.906977
|
6
|
SFD
|
0.630872
|
0.787879
|
7
|
6FA
|
0.61745
|
0.896552
|
8
|
JNT
|
0.6
|
0.835294
|
9
|
6YU
|
0.586207
|
0.903226
|
10
|
RFL
|
0.585987
|
0.876405
|
11
|
FAD NBT
|
0.584906
|
0.902174
|
12
|
FAY
|
0.579618
|
0.895349
|
13
|
CNV FAD
|
0.578616
|
0.954023
|
14
|
FAJ
|
0.575758
|
0.886364
|
15
|
62F
|
0.573248
|
0.895349
|
16
|
DAL FAD PER
|
0.573171
|
0.922222
|
17
|
FA9
|
0.554217
|
0.918605
|
18
|
FAD CNX
|
0.551515
|
0.873684
|
19
|
FAD T2C
|
0.547619
|
0.902174
|
20
|
P5F
|
0.545455
|
0.920455
|
21
|
UBG
|
0.540373
|
0.918605
|
22
|
FNR
|
0.532258
|
0.892857
|
23
|
FAD NBA
|
0.526012
|
0.873684
|
24
|
A2D
|
0.516667
|
0.833333
|
25
|
AR6
|
0.5
|
0.811765
|
26
|
APR
|
0.5
|
0.811765
|
27
|
M33
|
0.496
|
0.823529
|
28
|
BA3
|
0.495935
|
0.833333
|
29
|
P6G FDA
|
0.494186
|
0.827957
|
30
|
B4P
|
0.491935
|
0.833333
|
31
|
AP5
|
0.491935
|
0.833333
|
32
|
DJC FAD
|
0.489474
|
0.912088
|
33
|
ANP
|
0.488372
|
0.813953
|
34
|
AGS
|
0.484375
|
0.795455
|
35
|
ATP
|
0.480315
|
0.833333
|
36
|
HEJ
|
0.480315
|
0.833333
|
37
|
ADP
|
0.48
|
0.833333
|
38
|
48N
|
0.479167
|
0.818182
|
39
|
FB0
|
0.478261
|
0.819149
|
40
|
5FA
|
0.476562
|
0.833333
|
41
|
AQP
|
0.476562
|
0.833333
|
42
|
AT4
|
0.47619
|
0.804598
|
43
|
AN2
|
0.47619
|
0.823529
|
44
|
GTA
|
0.475524
|
0.831461
|
45
|
HQG
|
0.473684
|
0.823529
|
46
|
AD9
|
0.472868
|
0.813953
|
47
|
3OD
|
0.471014
|
0.835294
|
48
|
FAE
|
0.46988
|
0.896552
|
49
|
ATF
|
0.469697
|
0.804598
|
50
|
AP0
|
0.469388
|
0.860465
|
51
|
ACP
|
0.46875
|
0.835294
|
52
|
OAD
|
0.467153
|
0.835294
|
53
|
9X8
|
0.467153
|
0.795455
|
54
|
A3R
|
0.463235
|
0.827586
|
55
|
A1R
|
0.463235
|
0.827586
|
56
|
PAJ
|
0.463235
|
0.808989
|
57
|
G3A
|
0.461538
|
0.83908
|
58
|
T5A
|
0.46
|
0.896552
|
59
|
A22
|
0.459259
|
0.845238
|
60
|
8LQ
|
0.459259
|
0.825581
|
61
|
G5P
|
0.458333
|
0.83908
|
62
|
6YZ
|
0.455224
|
0.835294
|
63
|
DQV
|
0.455172
|
0.845238
|
64
|
ACQ
|
0.454545
|
0.835294
|
65
|
PRX
|
0.453846
|
0.793103
|
66
|
5AL
|
0.451128
|
0.823529
|
67
|
ADX
|
0.449612
|
0.741935
|
68
|
CA0
|
0.449612
|
0.813953
|
69
|
QA7
|
0.448529
|
0.816092
|
70
|
KG4
|
0.446154
|
0.813953
|
71
|
50T
|
0.446154
|
0.802326
|
72
|
8QN
|
0.445255
|
0.823529
|
73
|
45A
|
0.444444
|
0.790698
|
74
|
8LH
|
0.444444
|
0.804598
|
75
|
ABM
|
0.444444
|
0.790698
|
76
|
A
|
0.443548
|
0.809524
|
77
|
AMP
|
0.443548
|
0.809524
|
78
|
OMR
|
0.442953
|
0.782609
|
79
|
TXE
|
0.442953
|
0.892857
|
80
|
AMO
|
0.442029
|
0.825581
|
81
|
ADQ
|
0.442029
|
0.813953
|
82
|
139
|
0.440789
|
0.862069
|
83
|
ADJ
|
0.440789
|
0.822222
|
84
|
KMQ
|
0.440559
|
0.825581
|
85
|
B5M
|
0.440559
|
0.837209
|
86
|
8LE
|
0.440298
|
0.816092
|
87
|
PTJ
|
0.439716
|
0.818182
|
88
|
ME8
|
0.439716
|
0.771739
|
89
|
BIS
|
0.439716
|
0.786517
|
90
|
TXA
|
0.439716
|
0.825581
|
91
|
AFH
|
0.438356
|
0.788889
|
92
|
A4P
|
0.437086
|
0.876405
|
93
|
UP5
|
0.436242
|
0.880952
|
94
|
DND
|
0.436242
|
0.825581
|
95
|
TXD
|
0.436242
|
0.870588
|
96
|
6V0
|
0.436242
|
0.882353
|
97
|
5SV
|
0.434783
|
0.758242
|
98
|
SRP
|
0.433824
|
0.804598
|
99
|
4AD
|
0.431655
|
0.816092
|
100
|
DJ0 FAD
|
0.430769
|
0.847826
|
101
|
B5Y
|
0.430556
|
0.837209
|
102
|
P1H
|
0.430303
|
0.842697
|
103
|
FYA
|
0.429577
|
0.823529
|
104
|
SRA
|
0.428571
|
0.772727
|
105
|
AHX
|
0.428571
|
0.797753
|
106
|
AMP MG
|
0.428571
|
0.776471
|
107
|
P33 FDA
|
0.427778
|
0.821053
|
108
|
MAP
|
0.427536
|
0.795455
|
109
|
AU1
|
0.427481
|
0.813953
|
110
|
NAI
|
0.426667
|
0.870588
|
111
|
25L
|
0.426573
|
0.845238
|
112
|
AP2
|
0.426357
|
0.825581
|
113
|
A12
|
0.426357
|
0.825581
|
114
|
OZV
|
0.42446
|
0.811765
|
115
|
EAD
|
0.423313
|
0.862069
|
116
|
COD
|
0.423077
|
0.806452
|
117
|
PR8
|
0.422535
|
0.8
|
118
|
T99
|
0.422222
|
0.804598
|
119
|
TAT
|
0.422222
|
0.804598
|
120
|
APC
|
0.421053
|
0.825581
|
121
|
4TC
|
0.421053
|
0.882353
|
122
|
ADP MG
|
0.419847
|
0.788235
|
123
|
ADP BEF
|
0.419847
|
0.788235
|
124
|
1ZZ
|
0.41958
|
0.771739
|
125
|
NB8
|
0.41958
|
0.797753
|
126
|
GA7
|
0.418919
|
0.825581
|
127
|
4UU
|
0.418919
|
0.837209
|
128
|
00A
|
0.41844
|
0.786517
|
129
|
ADV
|
0.41791
|
0.804598
|
130
|
RBY
|
0.41791
|
0.804598
|
131
|
A3D
|
0.417722
|
0.835294
|
132
|
NAX
|
0.417219
|
0.862069
|
133
|
ANP MG
|
0.416058
|
0.781609
|
134
|
VO4 ADP
|
0.416058
|
0.793103
|
135
|
OOB
|
0.414286
|
0.823529
|
136
|
25A
|
0.414286
|
0.833333
|
137
|
LAD
|
0.412587
|
0.788889
|
138
|
UPA
|
0.411765
|
0.870588
|
139
|
CNA
|
0.410256
|
0.825581
|
140
|
80F
|
0.408805
|
0.833333
|
141
|
V2G
|
0.408759
|
0.83908
|
142
|
DLL
|
0.408451
|
0.823529
|
143
|
XAH
|
0.408163
|
0.771739
|
144
|
4UW
|
0.407895
|
0.829545
|
145
|
F2R
|
0.407643
|
0.793478
|
146
|
ATP MG
|
0.407407
|
0.788235
|
147
|
APC MG
|
0.407407
|
0.770115
|
148
|
ADP PO3
|
0.407407
|
0.788235
|
149
|
DAL AMP
|
0.407143
|
0.802326
|
150
|
3UK
|
0.405594
|
0.835294
|
151
|
4UV
|
0.405405
|
0.837209
|
152
|
TYM
|
0.405229
|
0.825581
|
153
|
NAD
|
0.405063
|
0.823529
|
154
|
BEF ADP
|
0.404412
|
0.770115
|
155
|
9ZD
|
0.404255
|
0.827586
|
156
|
9ZA
|
0.404255
|
0.827586
|
157
|
9SN
|
0.40411
|
0.797753
|
158
|
WAQ
|
0.402778
|
0.806818
|
159
|
B5V
|
0.402778
|
0.825581
|
160
|
L3W
|
0.402597
|
0.869048
|
161
|
FA5
|
0.401361
|
0.825581
|
162
|
YLP
|
0.401316
|
0.793478
|
No: |
Ligand |
Similarity coefficient |
1
|
FDA T2C
|
0.8779
|
This union binding pocket(no: 1) in the query (biounit: 6u1v.bio1) has 36 residues
|
No: |
Leader PDB |
Ligand |
Sequence Similarity
|
This union binding pocket(no: 2) in the query (biounit: 6u1v.bio1) has 36 residues
|
No: |
Leader PDB |
Ligand |
Sequence Similarity
|
This union binding pocket(no: 3) in the query (biounit: 6u1v.bio1) has 36 residues
|
No: |
Leader PDB |
Ligand |
Sequence Similarity
|
This union binding pocket(no: 4) in the query (biounit: 6u1v.bio1) has 36 residues
|
No: |
Leader PDB |
Ligand |
Sequence Similarity
|
APoc FAQ