| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
F |
152 |
35 |
7758 |
◊ |
E |
x,y,z |
1_555 |
150 |
36 |
8207 |
1405.8 |
-22.1 |
0.032 |
12 |
0 |
0 |
0.636 |
2 |
|
D |
151 |
37 |
7982 |
◊ |
C |
x,y,z |
1_555 |
153 |
37 |
8199 |
1381.3 |
-18.5 |
0.102 |
12 |
0 |
0 |
0.636 |
3 |
|
B |
135 |
36 |
7975 |
◊ |
A |
x,y,z |
1_555 |
125 |
32 |
8192 |
1161.6 |
-17.6 |
0.073 |
10 |
0 |
0 |
0.636 |
| Average: |
1316.3 |
-19.4 |
0.069 |
11 |
0 |
0 |
0.636 |
| 2 |
4 |
|
E |
130 |
33 |
8207 |
◊ |
C |
x,y,z |
1_555 |
126 |
33 |
8199 |
1209.3 |
-5.7 |
0.569 |
21 |
7 |
0 |
0.615 |
5 |
|
F |
125 |
31 |
7758 |
◊ |
B |
x,y,z |
1_555 |
126 |
32 |
7975 |
1144.8 |
-7.2 |
0.508 |
18 |
4 |
0 |
0.615 |
6 |
|
D |
123 |
31 |
7982 |
◊ |
A |
x,y,z |
1_555 |
122 |
33 |
8192 |
1132.9 |
-8.2 |
0.479 |
20 |
3 |
0 |
0.615 |
| Average: |
1162.3 |
-7.0 |
0.518 |
20 |
5 |
0 |
0.615 |
| 3 |
7 |
|
C |
39 |
12 |
8199 |
◊ |
D |
-x-2,y-1/2,-z+5/2 |
3_347 |
40 |
14 |
7982 |
402.7 |
-1.9 |
0.547 |
5 |
1 |
0 |
0.000 |
| 4 |
8 |
|
B |
42 |
15 |
7975 |
◊ |
E |
x-1/2,-y+3/2,-z+2 |
4_467 |
37 |
12 |
8207 |
377.2 |
-2.6 |
0.470 |
3 |
2 |
0 |
0.000 |
| 5 |
9 |
|
A |
40 |
12 |
8192 |
◊ |
F |
x-1/2,-y+1/2,-z+2 |
4_457 |
47 |
14 |
7758 |
372.6 |
-0.7 |
0.640 |
4 |
1 |
0 |
0.000 |
| 6 |
10 |
|
A |
43 |
17 |
8192 |
◊ |
E |
x-1,y,z |
1_455 |
37 |
15 |
8207 |
282.9 |
2.5 |
0.876 |
1 |
0 |
0 |
0.000 |
| 7 |
11 |
|
[SCB]A:3001 |
32 |
1 |
701 |
f |
A |
x,y,z |
1_555 |
35 |
11 |
8192 |
278.1 |
-1.8 |
0.378 |
0 |
0 |
0 |
0.052 |
| 8 |
12 |
|
[SCB]A:3001 |
31 |
1 |
701 |
◊ |
B |
x,y,z |
1_555 |
41 |
10 |
7975 |
263.1 |
2.4 |
0.546 |
1 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[BEN]C:2004 |
9 |
1 |
282 |
◊ |
C |
x,y,z |
1_555 |
30 |
12 |
8199 |
197.2 |
4.8 |
0.453 |
1 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[BEN]B:2001 |
9 |
1 |
283 |
◊ |
B |
x,y,z |
1_555 |
30 |
14 |
7975 |
176.9 |
4.7 |
0.480 |
1 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[BEN]A:2002 |
9 |
1 |
279 |
◊ |
A |
x,y,z |
1_555 |
18 |
5 |
8192 |
132.2 |
2.9 |
0.169 |
1 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[BEN]E:2007 |
9 |
1 |
281 |
◊ |
E |
x,y,z |
1_555 |
13 |
5 |
8207 |
112.1 |
2.7 |
0.146 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[BEN]C:2005 |
9 |
1 |
281 |
f |
C |
x,y,z |
1_555 |
16 |
8 |
8199 |
111.1 |
2.3 |
0.091 |
2 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[BEN]A:2003 |
9 |
1 |
282 |
◊ |
E |
x-1,y,z |
1_455 |
15 |
4 |
8207 |
102.4 |
2.4 |
0.121 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[BEN]A:2002 |
9 |
1 |
279 |
f |
E |
x-1,y,z |
1_455 |
15 |
6 |
8207 |
102.1 |
1.7 |
0.070 |
1 |
0 |
0 |
0.000 |
| 16 |
20 |
|
C |
13 |
6 |
8199 |
◊ |
[BEN]D:2006 |
-x-2,y-1/2,-z+5/2 |
3_347 |
7 |
1 |
281 |
102.0 |
2.6 |
0.197 |
2 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[BEN]A:2003 |
9 |
1 |
282 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
8192 |
100.8 |
2.1 |
0.067 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
B |
15 |
8 |
7975 |
f |
[BEN]E:2007 |
x-1/2,-y+3/2,-z+2 |
4_467 |
9 |
1 |
281 |
82.3 |
1.9 |
0.053 |
1 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[BEN]C:2005 |
9 |
1 |
281 |
◊ |
D |
-x-2,y-1/2,-z+5/2 |
3_347 |
10 |
4 |
7982 |
80.0 |
2.4 |
0.081 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[BEN]C:2005 |
6 |
1 |
281 |
◊ |
[BEN]D:2006 |
-x-2,y-1/2,-z+5/2 |
3_347 |
9 |
1 |
281 |
59.9 |
2.8 |
0.006 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
[CL]B:1002 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
7975 |
58.7 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.498 |
26 |
|
[CL]D:1004 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
7982 |
58.0 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.498 |
27 |
|
[CL]A:1001 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
8192 |
55.5 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.498 |
28 |
|
[CL]F:1006 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
12 |
7 |
7758 |
52.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.498 |
29 |
|
[CL]C:1003 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
8199 |
51.9 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.498 |
30 |
|
[CL]F:1005 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
10 |
6 |
8207 |
49.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.498 |
| Average: |
54.4 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.498 |
| 22 |
31 |
|
[CL]F:1005 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
7758 |
51.0 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.243 |
32 |
|
[CL]C:1003 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
7982 |
49.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.243 |
33 |
|
[CL]F:1006 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
8 |
4 |
8207 |
47.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.243 |
34 |
|
[CL]B:1002 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
8192 |
20.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.243 |
35 |
|
[CL]A:1001 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
7975 |
10.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.243 |
36 |
|
[CL]D:1004 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
8199 |
6.4 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.243 |
| Average: |
31.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.243 |
| 23 |
37 |
|
[SCB]A:3001 |
5 |
1 |
701 |
f |
[CL]A:1001 |
x,y,z |
1_555 |
1 |
1 |
125 |
38.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.094 |
| 24 |
38 |
|
[BEN]C:2004 |
3 |
1 |
282 |
f |
D |
x,y,z |
1_555 |
4 |
1 |
7982 |
23.0 |
-0.3 |
0.103 |
0 |
0 |
0 |
0.008 |
| 25 |
39 |
|
[SCB]A:3001 |
5 |
1 |
701 |
f |
[BEN]B:2001 |
x,y,z |
1_555 |
2 |
1 |
283 |
20.1 |
0.9 |
0.232 |
0 |
0 |
0 |
0.000 |
| 26 |
40 |
|
[BEN]B:2001 |
1 |
1 |
283 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
8192 |
10.6 |
-0.0 |
0.286 |
0 |
0 |
0 |
0.000 |
| 27 |
41 |
|
[BEN]D:2006 |
2 |
1 |
281 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
7982 |
8.4 |
0.4 |
0.293 |
0 |
0 |
0 |
0.000 |
|