## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
184 |
49 |
19761 |
x |
A |
-y+1,x-y,z |
2_655 |
187 |
47 |
19761 |
1605.5 |
-13.3 |
0.452 |
24 |
14 |
0 |
0.260 |
2 |
|
[BCL]A:374 |
62 |
1 |
1155 |
f |
A |
x,y,z |
1_555 |
88 |
32 |
19761 |
600.3 |
-14.7 |
0.117 |
1 |
0 |
0 |
0.186 |
3 |
|
[BCL]A:376 |
63 |
1 |
1307 |
f |
A |
x,y,z |
1_555 |
94 |
39 |
19761 |
591.2 |
-11.7 |
0.213 |
2 |
0 |
0 |
0.154 |
4 |
|
[BCL]A:375 |
64 |
1 |
1373 |
f |
A |
x,y,z |
1_555 |
86 |
33 |
19761 |
583.9 |
-11.7 |
0.164 |
0 |
0 |
0 |
0.144 |
5 |
|
[BCL]A:371 |
63 |
1 |
1043 |
◊ |
A |
x,y,z |
1_555 |
85 |
25 |
19761 |
536.1 |
-11.6 |
0.190 |
0 |
0 |
0 |
0.142 |
6 |
|
[BCL]A:373 |
49 |
1 |
1331 |
f |
A |
x,y,z |
1_555 |
81 |
32 |
19761 |
532.3 |
-11.8 |
0.183 |
2 |
0 |
0 |
0.155 |
7 |
|
[BCL]A:372 |
53 |
1 |
1337 |
◊ |
A |
x,y,z |
1_555 |
77 |
25 |
19761 |
494.9 |
-8.7 |
0.173 |
1 |
0 |
0 |
0.092 |
8 |
|
[BCL]A:377 |
57 |
1 |
1254 |
f |
A |
x,y,z |
1_555 |
65 |
26 |
19761 |
459.9 |
-7.5 |
0.178 |
1 |
0 |
0 |
0.097 |
9 |
|
A |
50 |
15 |
19761 |
x |
A |
-x+1,-y+1,z-1/2 |
4_664 |
34 |
9 |
19761 |
377.4 |
2.0 |
0.938 |
6 |
5 |
0 |
0.000 |
10 |
|
[BCL]A:378 |
42 |
1 |
890 |
cf |
A |
-y+1,x-y,z |
2_655 |
52 |
14 |
19761 |
369.6 |
-9.1 |
0.421 |
1 |
0 |
0 |
0.117 |
11 |
|
[BCL]A:376 |
34 |
1 |
1307 |
f |
[BCL]A:375 |
x,y,z |
1_555 |
45 |
1 |
1373 |
275.3 |
-3.5 |
0.650 |
0 |
0 |
0 |
0.042 |
12 |
|
[BCL]A:378 |
37 |
1 |
890 |
c |
A |
x,y,z |
1_555 |
30 |
8 |
19761 |
238.4 |
-6.5 |
0.336 |
0 |
0 |
0 |
0.065 |
13 |
|
[BCL]A:377 |
46 |
1 |
1254 |
f |
[BCL]A:373 |
x,y,z |
1_555 |
31 |
1 |
1331 |
214.6 |
0.2 |
0.837 |
0 |
0 |
0 |
0.000 |
14 |
|
[BCL]A:374 |
26 |
1 |
1155 |
f |
[BCL]A:375 |
x,y,z |
1_555 |
28 |
1 |
1373 |
197.1 |
-0.4 |
0.781 |
0 |
0 |
0 |
0.005 |
15 |
|
A |
24 |
7 |
19761 |
f |
[BCL]A:372 |
-y+1,x-y,z |
2_655 |
23 |
1 |
1337 |
190.9 |
-5.1 |
0.289 |
3 |
0 |
0 |
0.078 |
16 |
|
[BCL]A:372 |
25 |
1 |
1337 |
◊ |
[BCL]A:371 |
x,y,z |
1_555 |
24 |
1 |
1043 |
189.9 |
-0.4 |
0.790 |
0 |
0 |
0 |
0.003 |
17 |
|
[BCL]A:377 |
18 |
1 |
1254 |
◊ |
[BCL]A:372 |
x,y,z |
1_555 |
41 |
1 |
1337 |
180.7 |
0.0 |
0.822 |
0 |
0 |
0 |
0.000 |
18 |
|
[BCL]A:374 |
18 |
1 |
1155 |
f |
[BCL]A:373 |
x,y,z |
1_555 |
29 |
1 |
1331 |
152.3 |
-0.9 |
0.731 |
0 |
0 |
0 |
0.011 |
19 |
|
[BCL]A:376 |
33 |
1 |
1307 |
f |
[BCL]A:373 |
x,y,z |
1_555 |
9 |
1 |
1331 |
130.3 |
-0.1 |
0.705 |
0 |
0 |
0 |
0.001 |
20 |
|
[BCL]A:377 |
13 |
1 |
1254 |
f |
[BCL]A:375 |
x,y,z |
1_555 |
15 |
1 |
1373 |
116.0 |
-2.5 |
0.447 |
0 |
0 |
0 |
0.031 |
21 |
|
[EDO]A:391 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
19761 |
111.2 |
4.1 |
0.565 |
2 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:386 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
19761 |
107.8 |
3.0 |
0.484 |
1 |
0 |
0 |
0.000 |
23 |
|
[EDO]A:385 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
22 |
7 |
19761 |
107.6 |
3.6 |
0.539 |
3 |
0 |
0 |
0.000 |
24 |
|
[EDO]A:381 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
19761 |
106.3 |
2.7 |
0.487 |
2 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:390 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
19761 |
105.0 |
2.9 |
0.510 |
4 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:387 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
19761 |
103.0 |
3.2 |
0.542 |
4 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:380 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
19761 |
102.1 |
3.5 |
0.519 |
1 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:382 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
19761 |
99.9 |
3.3 |
0.529 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:384 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
19761 |
97.4 |
3.8 |
0.558 |
2 |
0 |
0 |
0.000 |
30 |
|
A |
13 |
6 |
19761 |
◊ |
[BCL]A:371 |
-y+1,x-y,z |
2_655 |
13 |
1 |
1043 |
97.1 |
-2.8 |
0.355 |
0 |
0 |
0 |
0.024 |
31 |
|
[BCL]A:376 |
16 |
1 |
1307 |
◊ |
[BCL]A:372 |
x,y,z |
1_555 |
12 |
1 |
1337 |
96.9 |
-0.7 |
0.665 |
0 |
0 |
0 |
0.007 |
32 |
|
[BCL]A:373 |
13 |
1 |
1331 |
◊ |
[BCL]A:372 |
x,y,z |
1_555 |
9 |
1 |
1337 |
95.6 |
1.1 |
0.798 |
0 |
0 |
0 |
0.000 |
33 |
|
[BCL]A:373 |
15 |
1 |
1331 |
f |
[BCL]A:375 |
x,y,z |
1_555 |
9 |
1 |
1373 |
95.0 |
0.0 |
0.706 |
0 |
0 |
0 |
0.000 |
34 |
|
[EDO]A:383 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
19761 |
93.2 |
2.7 |
0.492 |
0 |
0 |
0 |
0.000 |
35 |
|
[BCL]A:378 |
6 |
1 |
890 |
◊ |
[BCL]A:371 |
-y+1,x-y,z |
2_655 |
16 |
1 |
1043 |
92.7 |
-1.5 |
0.609 |
0 |
0 |
0 |
0.019 |
36 |
|
[EDO]A:393 |
4 |
1 |
185 |
cf |
A |
x,y,z |
1_555 |
10 |
5 |
19761 |
91.3 |
2.8 |
0.506 |
5 |
0 |
0 |
0.000 |
37 |
|
[BCL]A:377 |
10 |
1 |
1254 |
f |
[BCL]A:374 |
x,y,z |
1_555 |
10 |
1 |
1155 |
89.7 |
-1.3 |
0.538 |
0 |
0 |
0 |
0.016 |
38 |
|
[EDO]A:392 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
10 |
7 |
19761 |
89.0 |
2.0 |
0.245 |
1 |
0 |
0 |
0.000 |
39 |
|
[BCL]A:377 |
9 |
1 |
1254 |
f |
[BCL]A:376 |
x,y,z |
1_555 |
11 |
1 |
1307 |
83.7 |
-1.3 |
0.538 |
0 |
0 |
0 |
0.016 |
40 |
|
[EDO]A:389 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
19761 |
75.8 |
2.0 |
0.490 |
2 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:388 |
4 |
1 |
184 |
◊ |
A |
-y+1,x-y,z |
2_655 |
9 |
4 |
19761 |
63.1 |
2.1 |
0.476 |
0 |
0 |
0 |
0.000 |
42 |
|
[NA]A:1232 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
19761 |
61.9 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.099 |
43 |
|
[EDO]A:379 |
4 |
1 |
184 |
◊ |
A |
-y+1,x-y,z |
2_655 |
10 |
3 |
19761 |
58.7 |
1.8 |
0.840 |
0 |
0 |
0 |
0.000 |
44 |
|
[EDO]A:388 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
19761 |
54.5 |
1.2 |
0.900 |
2 |
0 |
0 |
0.000 |
45 |
|
[EDO]A:389 |
3 |
1 |
181 |
◊ |
A |
-y+1,x-y,z |
2_655 |
11 |
4 |
19761 |
51.3 |
0.5 |
0.219 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
4 |
3 |
19761 |
◊ |
[EDO]A:393 |
-x+1,-y+1,z-1/2 |
4_664 |
4 |
1 |
185 |
49.4 |
1.8 |
0.887 |
0 |
0 |
0 |
0.000 |
47 |
|
[EDO]A:379 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
19761 |
49.4 |
2.1 |
0.956 |
0 |
0 |
0 |
0.000 |
48 |
|
A |
5 |
2 |
19761 |
◊ |
[BCL]A:377 |
-y+1,x-y,z |
2_655 |
6 |
1 |
1254 |
43.7 |
1.4 |
0.793 |
0 |
0 |
0 |
0.000 |
49 |
|
[BCL]A:376 |
2 |
1 |
1307 |
◊ |
[BCL]A:371 |
x,y,z |
1_555 |
3 |
1 |
1043 |
40.6 |
-0.6 |
0.429 |
0 |
0 |
0 |
0.007 |
50 |
|
[BCL]A:377 |
3 |
1 |
1254 |
◊ |
[BCL]A:371 |
x,y,z |
1_555 |
5 |
1 |
1043 |
38.7 |
-0.4 |
0.628 |
0 |
0 |
0 |
0.005 |
51 |
|
[BCL]A:374 |
2 |
1 |
1155 |
◊ |
[BCL]A:372 |
x,y,z |
1_555 |
6 |
1 |
1337 |
33.4 |
0.4 |
0.713 |
0 |
0 |
0 |
0.000 |
52 |
|
[EDO]A:379 |
3 |
1 |
184 |
◊ |
[EDO]A:381 |
-y+1,x-y,z |
2_655 |
3 |
1 |
185 |
31.2 |
1.7 |
1.000 |
0 |
0 |
0 |
0.000 |
53 |
|
[EDO]A:392 |
3 |
1 |
186 |
f |
A |
-x+1,-y+1,z-1/2 |
4_664 |
5 |
2 |
19761 |
30.5 |
0.7 |
0.836 |
0 |
0 |
0 |
0.000 |
54 |
|
[EDO]A:388 |
3 |
1 |
184 |
x |
[EDO]A:388 |
-y+1,x-y,z |
2_655 |
4 |
1 |
184 |
27.1 |
1.1 |
1.000 |
0 |
0 |
0 |
0.000 |
55 |
|
[EDO]A:386 |
2 |
1 |
183 |
f |
[EDO]A:384 |
x,y,z |
1_555 |
2 |
1 |
184 |
25.1 |
1.6 |
1.000 |
0 |
0 |
0 |
0.000 |
56 |
|
[NH4]A:2378 |
1 |
1 |
117 |
x |
A |
x,y,z |
1_555 |
3 |
1 |
19761 |
25.0 |
0.6 |
0.929 |
0 |
0 |
0 |
0.000 |
57 |
|
[EDO]A:389 |
3 |
1 |
181 |
◊ |
[BCL]A:377 |
-y+1,x-y,z |
2_655 |
4 |
1 |
1254 |
24.5 |
1.0 |
0.884 |
0 |
0 |
0 |
0.000 |
58 |
|
[BCL]A:376 |
2 |
1 |
1307 |
f |
[BCL]A:374 |
x,y,z |
1_555 |
2 |
1 |
1155 |
23.1 |
-0.7 |
0.355 |
0 |
0 |
0 |
0.009 |
59 |
|
[EDO]A:379 |
1 |
1 |
184 |
fx |
[EDO]A:379 |
-y+1,x-y,z |
2_655 |
3 |
1 |
184 |
19.2 |
0.7 |
1.000 |
1 |
0 |
0 |
0.000 |
60 |
|
A |
2 |
1 |
19761 |
◊ |
[BCL]A:373 |
-y+1,x-y,z |
2_655 |
1 |
1 |
1331 |
18.3 |
-0.4 |
0.325 |
0 |
0 |
0 |
0.004 |
61 |
|
[NH4]A:2378 |
1 |
1 |
117 |
x |
[EDO]A:388 |
x,y,z |
1_555 |
2 |
1 |
184 |
14.7 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
62 |
|
A |
3 |
1 |
19761 |
f |
[EDO]A:381 |
-y+1,x-y,z |
2_655 |
2 |
1 |
185 |
10.4 |
0.3 |
0.900 |
0 |
0 |
0 |
0.000 |
63 |
|
A |
2 |
1 |
19761 |
f |
[EDO]A:388 |
-y+1,x-y,z |
2_655 |
1 |
1 |
184 |
8.7 |
0.2 |
0.897 |
0 |
0 |
0 |
0.000 |
64 |
|
[BCL]A:375 |
1 |
1 |
1373 |
◊ |
[BCL]A:372 |
x,y,z |
1_555 |
2 |
1 |
1337 |
5.1 |
0.3 |
0.784 |
0 |
0 |
0 |
0.000 |
65 |
|
[BCL]A:378 |
1 |
1 |
890 |
◊ |
[BCL]A:372 |
-y+1,x-y,z |
2_655 |
1 |
1 |
1337 |
2.4 |
0.0 |
0.772 |
0 |
0 |
0 |
0.000 |
|