Receptor
PDB id Resolution Class Description Source Keywords
3FSJ 1.37 Å EC: 4.1.1.7 CRYSTAL STRUCTURE OF BENZOYLFORMATE DECARBOXYLASE IN COMPLEX WITH THE INHIBITOR MBP PSEUDOMONAS PUTIDA THIAMIN ADDUCT AROMATIC HYDROCARBONS CATABOLISM CALCIUM DECARBOXYLASE LYASE MAGNESIUM MANDELATE PATHWAY METAL BINDING THIAMINE PYROPHOSPHATE METAL-BINDING
Ref.: SNAPSHOT OF A REACTION INTERMEDIATE: ANALYSIS OF BENZOYLFORMATE DECARBOXYLASE IN COMPLEX WITH A BENZOYLPHOSPHONATE INHIBITOR. BIOCHEMISTRY V. 48 3247 2009
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data NGL Viewer Molecular Weight (Da) Formula SMILES
CA X:600;
Part of Protein;
none;
submit data
40.078 Ca [Ca+2...
D7K X:601;
Valid;
none;
Kd = 5.49 mM
625.443 C20 H28 N4 O11 P3 S Cc1c(...
View in 3D viewer
90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3FSJ 1.37 Å EC: 4.1.1.7 CRYSTAL STRUCTURE OF BENZOYLFORMATE DECARBOXYLASE IN COMPLEX WITH THE INHIBITOR MBP PSEUDOMONAS PUTIDA THIAMIN ADDUCT AROMATIC HYDROCARBONS CATABOLISM CALCIUM DECARBOXYLASE LYASE MAGNESIUM MANDELATE PATHWAY METAL BINDING THIAMINE PYROPHOSPHATE METAL-BINDING
Ref.: SNAPSHOT OF A REACTION INTERMEDIATE: ANALYSIS OF BENZOYLFORMATE DECARBOXYLASE IN COMPLEX WITH A BENZOYLPHOSPHONATE INHIBITOR. BIOCHEMISTRY V. 48 3247 2009
Members (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4GM1 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
2 1YNO - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
3 4GM0 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
4 4GG1 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
5 3FZN - D7K C20 H28 N4 O11 P3 S Cc1c(sc([n....
6 4GPE - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
7 4MQ5 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
8 1PI3 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
9 1BFD - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
10 2FWN - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
11 1PO7 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
12 3F6B - 8PA C20 H26 N5 O8 P2 S Cc1c(sc([n....
13 4JD5 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
14 3FSJ Kd = 5.49 mM D7K C20 H28 N4 O11 P3 S Cc1c(sc([n....
15 4GP9 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
16 4GM4 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
17 3F6E - 8PA C20 H26 N5 O8 P2 S Cc1c(sc([n....
18 4MPR - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
19 1Q6Z - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
70% Homology Family (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4GM1 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
2 1YNO - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
3 4GM0 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
4 4GG1 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
5 3FZN - D7K C20 H28 N4 O11 P3 S Cc1c(sc([n....
6 4GPE - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
7 4MQ5 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
8 1PI3 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
9 1BFD - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
10 2FWN - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
11 1PO7 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
12 3F6B - 8PA C20 H26 N5 O8 P2 S Cc1c(sc([n....
13 4JD5 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
14 3FSJ Kd = 5.49 mM D7K C20 H28 N4 O11 P3 S Cc1c(sc([n....
15 4GP9 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
16 4GM4 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
17 3F6E - 8PA C20 H26 N5 O8 P2 S Cc1c(sc([n....
18 4MPR - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
19 1Q6Z - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
50% Homology Family (19)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 1 families.
1 4GM1 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
2 1YNO - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
3 4GM0 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
4 4GG1 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
5 3FZN - D7K C20 H28 N4 O11 P3 S Cc1c(sc([n....
6 4GPE - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
7 4MQ5 - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
8 1PI3 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
9 1BFD - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
10 2FWN - TDP C12 H18 N4 O7 P2 S Cc1c(sc[n+....
11 1PO7 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
12 3F6B - 8PA C20 H26 N5 O8 P2 S Cc1c(sc([n....
13 4JD5 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
14 3FSJ Kd = 5.49 mM D7K C20 H28 N4 O11 P3 S Cc1c(sc([n....
15 4GP9 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
16 4GM4 - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
17 3F6E - 8PA C20 H26 N5 O8 P2 S Cc1c(sc([n....
18 4MPR - TPP C12 H19 N4 O7 P2 S Cc1c(sc[n+....
19 1Q6Z - TZD C12 H18 N4 O8 P2 S Cc1ncc(c(n....
Polypharmacology
Similar Ligands
Ligand no: 1; Ligand: D7K; Similar ligands found: 28
No: Ligand ECFP6 Tc MDL keys Tc
1 D7K 1 1
2 TDK 0.7 0.987013
3 TDL 0.640777 0.9375
4 T5X 0.59292 0.9375
5 T6F 0.59292 0.9375
6 THW 0.592593 0.948052
7 THY 0.570093 0.911392
8 HTL 0.567308 0.923077
9 THV 0.566038 0.923077
10 O2T 0.559633 0.949367
11 TDW 0.552381 0.935065
12 WWF 0.546296 0.9
13 TOG 0.526786 0.888889
14 TD6 0.517544 0.888889
15 TD9 0.508621 0.888889
16 TD8 0.508621 0.888889
17 8PA 0.495935 0.935897
18 5SR 0.490909 0.886076
19 TPP 0.490566 0.909091
20 PYI 0.462963 0.831169
21 V4E 0.459459 0.909091
22 TPW 0.435185 0.818182
23 1Y7 TDP 0.423077 0.9125
24 1U0 0.422414 0.835443
25 S1T 0.421053 0.831169
26 R1T 0.421053 0.831169
27 TDP 0.415929 0.896104
28 TPU 0.4 0.792683
Similar Binding Sites (Proteins are less than 50% similar to leader)
Pocket No.: 1; Query (leader) PDB : 3FSJ; Ligand: D7K; Similar sites found: 332
This union binding pocket(no: 1) in the query (biounit: 3fsj.bio1) has 33 residues
No: Leader PDB Ligand P-value (APoc) PS_Score (APoc) Sequence Similarity
1 1WAP TRP 0.01343 0.41186 None
2 3ZZS TRP 0.001308 0.40846 None
3 4EPL JAI 0.03396 0.40289 0.757576
4 2GWD GLU 0.0141 0.43442 1.11359
5 4UAL 3FV 0.02337 0.40671 1.19332
6 3UXL CFI 0.00062 0.40404 1.30548
7 2BH9 NAP 0.03788 0.40086 1.43149
8 3TKA CTN 0.03787 0.4367 1.44092
9 3TKA SAM 0.01012 0.41229 1.44092
10 1E4E ADP 0.01807 0.40828 1.45773
11 3BK2 U5P 0.03811 0.407 1.51515
12 1ZJ6 G3D 0.005947 0.44296 1.60428
13 3MAG SAH 0.02279 0.40138 1.62866
14 1MOQ GLP 0.0142 0.4125 1.63043
15 2RCN GDP 0.02058 0.42273 1.67598
16 1VCO GLN 0.0002871 0.4525 1.70455
17 2O2C G6Q 0.02236 0.41062 1.70455
18 1JQN DCO 0.001609 0.41053 1.70455
19 4OB6 S2T 0.03569 0.40196 1.75953
20 1Y7P RIP 0.04406 0.43336 1.79372
21 1TV5 ORO 0.0003277 0.4854 1.80587
22 1TV5 N8E 0.01478 0.4118 1.80587
23 1TV5 FMN 0.0008042 0.40103 1.80587
24 2FGQ MLT 0.03236 0.43029 1.80723
25 1G6O ADP 0.009104 0.4031 1.81818
26 3GTD MLI 0.02424 0.43195 1.86722
27 3B96 MYA 0.009198 0.41694 1.89394
28 1GPJ CIT 0.003465 0.48002 1.9802
29 1PEA ACM 0.02925 0.44323 2.07792
30 2CE7 ADP 0.02903 0.40896 2.10084
31 1FWY UD1 0.001045 0.41888 2.1148
32 2GGH NLQ 0.001306 0.40848 2.13333
33 4E28 0MZ 0.02409 0.43209 2.15385
34 2DWU DGL 0.000905 0.49012 2.17391
35 5T63 ALA ALA ALA ALA 0.01351 0.40469 2.17984
36 1QR0 COA 0.03611 0.41149 2.19298
37 1DRV A3D 0.0001992 0.40377 2.1978
38 1OLS TDP 0.002094 0.41903 2.25
39 4HPP GLU 0.001649 0.40547 2.25734
40 1O0S NAI 0.004767 0.41871 2.27273
41 2ZJ5 ADP 0.04705 0.41748 2.27273
42 3A1I UNU 0.0006249 0.49175 2.30326
43 1N6B DMZ 0.00001665 0.45812 2.32558
44 2ZI8 SDT 0.004309 0.4067 2.33333
45 2JFV FLC 0.02192 0.43901 2.4055
46 4MOB ADP 0.003812 0.44111 2.40964
47 1CBF SAH 0.02506 0.40851 2.45614
48 1K27 MTM 0.0006303 0.42578 2.4735
49 1MVQ MMA 0.00006463 0.46017 2.54237
50 4QN6 LNV 0.001384 0.40317 2.55754
51 4M51 BEZ 0.008413 0.47294 2.57611
52 4O8A 2OP 0.02481 0.4535 2.65152
53 1Z45 GAL 0.03449 0.42005 2.65152
54 4M7F BM3 0.0004448 0.51097 2.65487
55 1Z42 HBA 0.04398 0.45887 2.66272
56 4PNO U5P 0.001888 0.46034 2.77778
57 1F1V DHY 0.02631 0.42167 2.78638
58 3QV9 QV7 0.02749 0.42922 2.80561
59 3GJB AKG 0.04656 0.40991 2.82132
60 2Y7G AAE 0.02575 0.40801 2.83688
61 2HV8 GTP 0.006202 0.4117 2.90698
62 4M37 SAH 0.01007 0.41538 2.91545
63 2ZO9 MLI 0.01129 0.43259 2.91971
64 2YP9 SIA CMO 0.03518 0.40075 2.98211
65 1T10 F6P 0.009879 0.45135 3.0303
66 2Q1A 2KT 0.0001987 0.47353 3.07167
67 2NVK NAP 0.01157 0.44303 3.07377
68 4QDF 30Q 0.005052 0.40817 3.07692
69 1BGV GLU 0.0006674 0.40989 3.11804
70 2PMP C5P 0.004247 0.44515 3.125
71 4N69 SER 0.01037 0.4557 3.14685
72 3VOZ 04A 0.00003873 0.52101 3.1746
73 2DVZ GLU 0.04632 0.40649 3.18471
74 2Y7P SAL 0.02374 0.42793 3.21101
75 4WVH ASP HIS ASP ALA HIS ALA 0.03611 0.41516 3.2197
76 3SQG COM 0.003982 0.5075 3.22581
77 1ML4 PAL 0.003052 0.4243 3.24675
78 1QCA FUA 0.001393 0.4189 3.28639
79 1GXU 2HP 0.0004892 0.45885 3.2967
80 1LDM OXM 0.00178 0.47112 3.34347
81 1I2L DCS 0.006131 0.42387 3.34572
82 1UOU CMU 0.02299 0.41338 3.37553
83 2QF7 COA 0.04458 0.40079 3.40909
84 1A5Z OXM 0.0002721 0.55417 3.44828
85 1A5Z FBP 0.0006629 0.46177 3.44828
86 3KYF 5GP 5GP 0.01788 0.42552 3.4632
87 1JCM 137 0.003884 0.4082 3.4749
88 3I8P 840 0.001838 0.45641 3.51288
89 3K3G MMU 0.005225 0.4623 3.52941
90 1RZM E4P 0.002602 0.49323 3.5503
91 1RZM PEP 0.01862 0.43305 3.5503
92 1VJO PLP 0.02249 0.41052 3.56234
93 4JWX 1N4 0.01476 0.43793 3.57143
94 2IZ1 ATR 0.03333 0.42962 3.5865
95 3T1A 5MA 0.02791 0.40062 3.59848
96 1FW1 GSH 0.01323 0.42381 3.7037
97 1KBI PYR 0.005871 0.40721 3.7182
98 1KBI FMN 0.005871 0.40721 3.7182
99 1POC GEL 0.01791 0.4115 3.73134
100 1Z6K OAA 0.00007861 0.52925 3.75427
101 3RK0 AMP 0.02481 0.41537 3.79747
102 3P47 CYS 0.03737 0.41445 3.80952
103 4DN8 BMA 0.004782 0.47288 3.84615
104 2C9O ADP 0.001778 0.41165 3.94737
105 4B8V NDG NAG NAG NAG 0.008273 0.40205 3.94737
106 1QS8 IVA VAL VAL STA ALA STA 0.01077 0.40841 3.95137
107 3AHC TPP 0.001048 0.41228 3.97727
108 1QO0 BMD 0.03329 0.42965 4.08163
109 3QVL 5HY 0.0004169 0.40864 4.08163
110 2Q9U FMN 0.01515 0.41138 4.10628
111 3CI3 3PO 0.002422 0.41502 4.12371
112 3CI3 5AD 0.002422 0.41502 4.12371
113 4F8L GAL 0.01601 0.48035 4.13793
114 4QCK ASD 0.001921 0.42696 4.14508
115 2VAR AMP 0.00135 0.47658 4.15335
116 2VAR ANP 0.005249 0.42327 4.15335
117 2VAR KDG 0.02199 0.41771 4.15335
118 2VAR KDF 0.02648 0.4141 4.15335
119 3NKS ACJ 0.03644 0.40158 4.19287
120 4KOA NDP 0.0291 0.40274 4.2042
121 4AF5 CIT 0.04684 0.42194 4.21053
122 4NTX AMR 0.03242 0.42345 4.22222
123 3SIX GDP 0.01899 0.42056 4.24242
124 1CKM GTP 0.04656 0.40991 4.24242
125 4NM5 ADP 0.01527 0.40268 4.24403
126 2P69 PLP 0.02126 0.4348 4.24837
127 2WL9 MBD 0.003322 0.42147 4.2623
128 4IEN GDP 0.0006579 0.43846 4.29448
129 2NZ2 ASP 0.000008829 0.59257 4.35835
130 2NZ2 CIR 0.0003091 0.4514 4.35835
131 3MMR ABH 0.008548 0.40406 4.35835
132 3F81 STT 0.003919 0.49901 4.37158
133 1O51 ADP 0.01051 0.40089 4.38596
134 4IMG NGF 0.01025 0.41508 4.43686
135 3ZPG 5GP 0.0331 0.44631 4.45026
136 1DL7 NCH 0.04087 0.45504 4.46429
137 4B16 NAG 0.02285 0.46268 4.51128
138 3M0J OAF 0.0003615 0.43629 4.56026
139 2J5S KTA 0.003003 0.43966 4.56274
140 1NNS ASP 0.02934 0.41565 4.60123
141 1AX2 NDG GAL 0.02164 0.42988 4.60251
142 1UCN ADP 0.02961 0.40859 4.60526
143 3VCA PRO 0.04098 0.41841 4.61165
144 3B9Q MLI 0.03888 0.40051 4.63576
145 1ULE GLA GAL NAG 0.04175 0.43467 4.66667
146 3P7I P7I 0.0353 0.41955 4.6729
147 1MZV AMP 0.03977 0.40956 4.68085
148 1Y9Q MED 0.04161 0.42462 4.6875
149 1A8S PPI 0.0025 0.46198 4.7619
150 3UEC ALA ARG TPO LYS 0.003188 0.48858 4.79452
151 1J2Z SOG 0.0003041 0.48674 4.81482
152 1LYX PGA 0.03482 0.4055 4.83871
153 2Z9V PXM 0.03852 0.4177 4.84694
154 3HPF GAE 0.001794 0.40438 4.85933
155 3W54 RNB 0.04361 0.40121 4.86322
156 4OZJ ADP 0.001056 0.427 4.8951
157 1Y1A GSH 0.01552 0.48391 4.91803
158 3PC3 P1T 0.007934 0.41637 4.93359
159 2V5E SCR 0.008204 0.489 4.9505
160 1XX4 BAM 0.002013 0.48249 4.98084
161 1FX8 BOG 0.0002799 0.48576 4.98221
162 2C2A ADP 0.02922 0.40267 5.03876
163 2XBL M7P 0.02229 0.40132 5.05051
164 1JGS SAL 0.01765 0.47773 5.07246
165 4FUA PGH 0.00004311 0.48094 5.11628
166 4B7J G39 0.0006409 0.42284 5.11727
167 2OWZ CIT 0.0000344 0.5021 5.12048
168 2Q8M AMP 0.03632 0.40794 5.12048
169 4IU0 ABH 0.00494 0.42115 5.15152
170 3EW2 BTN 0.03752 0.41437 5.18518
171 2NCD ADP 0.01036 0.45034 5.47619
172 4EXO PYR 0.01608 0.45754 5.47945
173 1FNZ A2G 0.0004177 0.46143 5.48523
174 2JC9 ADN 0.02721 0.42506 5.49242
175 1L2T ATP 0.006998 0.41258 5.53191
176 3F8C HT1 0.01221 0.44678 5.55556
177 1QW9 KHP 0.005837 0.40992 5.57769
178 3QDY A2G GAL 0.01132 0.46588 5.59441
179 3QDY CBS 0.03615 0.43273 5.59441
180 3QDT A2G GAL 0.04854 0.43102 5.59441
181 4C2G ALA ALA ALA ALA 0.003234 0.46433 5.60538
182 2FH5 GTP 0.00002277 0.43681 5.60748
183 2ZSC BTN 0.01859 0.41741 5.67376
184 3NJQ NJQ 0.002016 0.42326 5.69948
185 3O7B SAH 0.008178 0.42217 5.7377
186 2EJU SAH 0.004794 0.4315 5.82011
187 1NML CIT 0.004414 0.46316 5.82822
188 1B74 DGN 0.01461 0.45983 5.90551
189 3VGL BGC 0.0002426 0.4482 5.919
190 3VGL ANP 0.0001368 0.43194 5.919
191 2WCI GSH 0.02641 0.43009 5.92593
192 4Q3S X7A 0.01013 0.40145 5.97403
193 4C81 CDP 0.01315 0.40935 5.97826
194 3LST SAH 0.02071 0.41536 6.03448
195 3NNF AKG 0.01794 0.4435 6.10465
196 4JEJ 1GP 0.006164 0.44227 6.14754
197 2DTJ THR 0.004981 0.45082 6.17978
198 3MD0 GDP 0.03328 0.41684 6.19718
199 4NVP 7CH 0.0002392 0.43035 6.2201
200 4P87 4NP 0.001123 0.43205 6.23441
201 3NKT 1HN 0.00509 0.40936 6.25
202 2C1Q BTN 0.0001778 0.42347 6.34921
203 4LKK SIA GAL 0.006459 0.42629 6.36943
204 4AF0 MOA 0.0009174 0.44158 6.43939
205 4AF0 IMP 0.0000804 0.41327 6.43939
206 2IYG FMN 0.01748 0.42216 6.45161
207 1BTN I3P 0.005839 0.51197 6.60377
208 1VE3 SAM 0.01115 0.41364 6.60793
209 1YRX FMN 0.005797 0.43932 6.61157
210 2Z5Y HRM 0.0003145 0.44446 6.62768
211 3CEV ARG 0.02487 0.42282 6.68896
212 3B9Z CO2 0.005499 0.46978 6.70103
213 1JN2 SFP 0.03177 0.46472 6.75105
214 1V8K ANP 0.0000474 0.46447 6.82927
215 1DXY COI 0.017 0.46286 6.90691
216 2CCV A2G 0.002502 0.42291 6.93069
217 1KYQ NAD 0.01022 0.41828 6.93431
218 1T0S BML 0.001337 0.51651 6.97674
219 3GX0 GDS 0.003566 0.43311 6.97674
220 1HV9 UD1 0.0009708 0.41989 7.01754
221 3PNA CMP 0.03215 0.41755 7.14286
222 1O7N IND 0.004422 0.42296 7.2165
223 1NVV GNP 0.00962 0.40225 7.22892
224 1RYD GLC 0.007038 0.46431 7.23514
225 1NF8 ISC 0.03898 0.40656 7.24638
226 3I8T LBT 0.00123 0.48979 7.31707
227 1JSH SIA GAL 0.002332 0.4334 7.38636
228 2C42 PYR 0.0005042 0.4217 7.38636
229 4LO6 SIA GAL 0.0008608 0.52262 7.3903
230 3MTW M3R 0.02015 0.41254 7.44417
231 2EB5 OXL 0.01225 0.452 7.49064
232 1FWE HAE 0.02066 0.42662 7.54717
233 2GN2 C5P 0.0003869 0.48 7.60234
234 3EJ0 11X 0.002963 0.42032 7.65306
235 2WK1 SAH 0.003938 0.42806 7.80142
236 4F4S EFO 0.007225 0.45287 7.89474
237 1S8F GDP 0.00477 0.44298 7.9096
238 2I3G NAP 0.003178 0.40373 7.95455
239 2VQ5 HBA 0.00686 0.47104 7.9602
240 1JOT GAL A2G 0.0000588 0.5383 8.27068
241 1ONX ASP 0.001601 0.42672 8.46154
242 1YBQ BDH 0.0005364 0.41994 8.46154
243 1Y75 NAG 0.02998 0.41899 8.47458
244 1B5E DCM 0.04768 0.40941 8.53659
245 3NOJ PYR 0.001432 0.48969 8.82353
246 2FJK 13P 0.02535 0.4089 8.85246
247 2WMO GTP 0.03741 0.40414 8.94737
248 4JCA CIT 0.001529 0.53196 8.98204
249 2WIC GNP 0.002266 0.42901 8.98876
250 1IZC PYR 0.000517 0.45795 9.14454
251 4JP3 CIT 0.03697 0.4076 9.20502
252 2HNK SAH 0.02345 0.40088 9.20502
253 3ZGE ASP 0.03327 0.44014 9.2803
254 1LSS NAD 0.01116 0.41067 9.28571
255 4L1F COS 0.008606 0.40926 9.39948
256 4AP9 1PS 0.0003023 0.47514 9.45274
257 1G8S MET 0.03967 0.4257 9.56522
258 3CH5 GDP 0.0006728 0.42219 9.61539
259 2BOI MFU 0.01423 0.43869 9.73451
260 1NXJ GLV 0.007679 0.44678 9.83607
261 1NXJ TLA 0.005674 0.43392 9.83607
262 2W24 LYS 0.001846 0.41894 10
263 1NU4 MLA 0.005099 0.45509 10.3093
264 3PHQ KDO 0.04392 0.45835 10.3604
265 1I1Q TRP 0.006988 0.4487 10.4167
266 2E1A MSE 0.01296 0.43613 10.6667
267 4USS GSH 0.007724 0.45148 10.7692
268 3NCQ ATP 0.01565 0.40499 10.9244
269 3S9K CIT 0.004182 0.53079 11.0169
270 1TH8 ADP 0.02931 0.41568 11.0345
271 4HE2 AMP 0.00003841 0.46739 11.2426
272 5RHN 8BR 0.01777 0.41486 11.3043
273 4Q3F TLA 0.008271 0.46072 11.9658
274 1Q6O LG6 0.01242 0.42144 12.037
275 4R3L COA 0.01989 0.41118 12.1387
276 2BJF DXC 0.0002941 0.41269 12.462
277 2WLT ASP 0.001271 0.42432 12.9518
278 2Y6P CTP 0.008602 0.44003 13.2479
279 1QS0 TDP 0.0002002 0.40292 13.2678
280 1UGX GAL MGC 0.003929 0.40804 13.5338
281 4B9E FAH 0.01931 0.44725 13.6213
282 1FP2 SAH 0.01919 0.4168 13.6364
283 3NGU ADP 0.0007577 0.47743 13.9073
284 1FS5 TLA 0.0002402 0.45343 13.9098
285 4G28 0W8 0.03288 0.41709 14.094
286 3QP6 HL6 0.03849 0.40359 14.3396
287 2PR5 FMN 0.02658 0.40148 14.3939
288 43CA NPO 0.04397 0.45521 14.5299
289 1WKL ATP 0.009811 0.41899 14.5985
290 1WKL ADP 0.01284 0.41428 14.5985
291 1KDK DHT 0.01099 0.40808 14.6893
292 2Q37 3AL 0.02586 0.43055 15.4696
293 1QH9 LAC 0.03585 0.42799 16.3793
294 2HVK TBA 0.0000003654 0.68253 16.895
295 1W7J ADP BEF 0.00725 0.42771 17.2185
296 4C25 13P 0.000635 0.43433 17.9245
297 1ECM TSA 0.03476 0.41594 18.3486
298 4COQ SAN 0.0209 0.44008 18.6235
299 2FEQ 34P 0.033 0.40047 19.4444
300 2A2X NA9 0.02833 0.40036 20.5882
301 1MXI SAH 0.005189 0.43012 21.25
302 3KJQ B94 0.04792 0.40251 24.2105
303 1QD0 RR6 0.01592 0.42397 24.2188
304 2P8O BVA 0.0001796 0.49367 25.9542
305 3KPE TM3 0.04704 0.42185 28.2051
306 1QPB TPP 0.017 0.43496 35.4167
307 1QPB PYM 0.01711 0.43483 35.4167
308 2X7J TPP 0.0005566 0.44528 36.9318
309 2Q28 TPP 0.00000001407 0.56127 37.1212
310 2Q28 ADP 0.007113 0.42133 37.1212
311 2VK4 TPP 0.000005238 0.47223 37.6894
312 3EYA TDP 0.00005091 0.43971 37.6894
313 1ZPD DPX 0.000002873 0.49643 38.3803
314 2IHT TPP 0.00000983 0.46206 38.8258
315 1UPA TPP 0.00001086 0.46093 38.8258
316 1YBH P22 0.00000006918 0.44686 39.2045
317 2IHU TP9 0.0000234 0.46 39.5833
318 2UZ1 TPP 0.0000008018 0.5608 40.5303
319 3IAE D7K 0.000005089 0.49723 40.5303
320 2NXW TPP 0.000008509 0.4936 40.5303
321 2VBF TPP 0.000003885 0.49177 41.2879
322 1V5F TPP 6.836e-17 0.67152 42.2348
323 1V5F FAD 0.0000005783 0.57666 42.2348
324 4KGD TDP 0.0000000007027 0.45794 42.4242
325 4KGD FAD 0.0000000007522 0.45418 42.4242
326 4RJK TDL 0.000002771 0.50156 42.6136
327 4RJK TPP 0.000001761 0.49734 42.6136
328 4RJK PYR 0.04737 0.43161 42.6136
329 2C31 TZD 0.0026 0.4336 43.5606
330 2C31 ADP 0.002511 0.4336 43.5606
331 1T9D P22 0.002955 0.52553 46.0227
332 1T9D PYD 0.001603 0.46501 46.0227
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