| ## |
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 |
|
D |
548 |
132 |
26857 |
◊ |
C |
x,y,z |
1_555 |
536 |
124 |
29620 |
5242.0 |
-64.7 |
0.025 |
60 |
27 |
0 |
0.974 |
2 |
|
B |
542 |
132 |
26710 |
◊ |
A |
x,y,z |
1_555 |
530 |
125 |
29735 |
5180.5 |
-64.8 |
0.017 |
62 |
32 |
0 |
0.974 |
| Average: |
5211.2 |
-64.7 |
0.021 |
61 |
30 |
0 |
0.974 |
| 2 |
3 |
|
[B12]C:800 |
80 |
1 |
1506 |
◊ |
C |
x,y,z |
1_555 |
153 |
55 |
29620 |
1147.7 |
-12.2 |
0.443 |
20 |
0 |
0 |
1.000 |
4 |
|
[B12]A:800 |
81 |
1 |
1497 |
◊ |
A |
x,y,z |
1_555 |
159 |
56 |
29735 |
1143.9 |
-12.6 |
0.463 |
20 |
0 |
0 |
1.000 |
| Average: |
1145.8 |
-12.4 |
0.453 |
20 |
0 |
0 |
1.000 |
| 3 |
5 |
|
[DCA]A:801 |
45 |
1 |
920 |
f |
A |
x,y,z |
1_555 |
89 |
32 |
29735 |
603.2 |
8.0 |
0.788 |
9 |
0 |
0 |
0.000 |
6 |
|
[DCA]C:801 |
45 |
1 |
918 |
f |
C |
x,y,z |
1_555 |
86 |
31 |
29620 |
602.6 |
7.5 |
0.777 |
10 |
0 |
0 |
0.000 |
| Average: |
602.9 |
7.7 |
0.783 |
10 |
0 |
0 |
0.000 |
| 4 |
7 |
|
C |
40 |
12 |
29620 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
36 |
13 |
26857 |
334.0 |
4.2 |
0.942 |
3 |
6 |
0 |
0.000 |
8 |
|
B |
31 |
12 |
26710 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
42 |
15 |
29735 |
291.2 |
2.8 |
0.922 |
1 |
1 |
0 |
0.000 |
| Average: |
312.6 |
3.5 |
0.932 |
2 |
4 |
0 |
0.000 |
| 5 |
9 |
|
C |
44 |
11 |
29620 |
◊ |
A |
x-1,y,z+1 |
1_456 |
40 |
11 |
29735 |
327.8 |
-3.0 |
0.479 |
1 |
0 |
0 |
0.000 |
| 6 |
10 |
|
A |
18 |
5 |
29735 |
◊ |
C |
x,y,z-1 |
1_554 |
21 |
8 |
29620 |
163.5 |
-1.1 |
0.555 |
3 |
4 |
0 |
0.000 |
| 7 |
11 |
|
D |
21 |
9 |
26857 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
7 |
29735 |
163.4 |
-2.9 |
0.208 |
0 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[GOL]B:1 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
25 |
13 |
26710 |
157.4 |
-0.1 |
0.655 |
5 |
0 |
0 |
0.030 |
| 9 |
13 |
|
[GOL]D:1 |
6 |
1 |
221 |
f |
D |
x,y,z |
1_555 |
21 |
12 |
26857 |
156.6 |
-0.1 |
0.590 |
4 |
0 |
0 |
0.037 |
| 10 |
14 |
|
C |
12 |
3 |
29620 |
x |
C |
x,y,z-1 |
1_554 |
13 |
4 |
29620 |
141.5 |
-1.8 |
0.322 |
2 |
1 |
0 |
0.000 |
| 11 |
15 |
|
[GOL]A:803 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
25 |
13 |
29735 |
141.4 |
-0.1 |
0.626 |
4 |
0 |
0 |
0.091 |
16 |
|
[GOL]C:803 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
23 |
13 |
29620 |
140.3 |
-0.3 |
0.596 |
3 |
0 |
0 |
0.091 |
| Average: |
140.9 |
-0.2 |
0.611 |
4 |
0 |
0 |
0.091 |
| 12 |
17 |
|
[GOL]B:639 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
23 |
8 |
26710 |
141.3 |
0.5 |
0.690 |
7 |
0 |
0 |
0.034 |
| 13 |
18 |
|
[GOL]D:639 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
20 |
9 |
26857 |
132.5 |
-0.5 |
0.581 |
6 |
0 |
0 |
0.063 |
| 14 |
19 |
|
[GOL]B:640 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
22 |
9 |
26710 |
130.2 |
-0.9 |
0.576 |
4 |
0 |
0 |
0.036 |
| 15 |
20 |
|
B |
14 |
5 |
26710 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
7 |
26857 |
126.7 |
0.9 |
0.794 |
3 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[GOL]C:802 |
6 |
1 |
223 |
f |
C |
x,y,z |
1_555 |
22 |
10 |
29620 |
114.9 |
-0.5 |
0.533 |
2 |
0 |
0 |
0.074 |
22 |
|
[GOL]A:802 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
29735 |
112.8 |
-0.7 |
0.471 |
2 |
0 |
0 |
0.074 |
| Average: |
113.8 |
-0.6 |
0.502 |
2 |
0 |
0 |
0.074 |
| 17 |
23 |
|
[GOL]A:802 |
5 |
1 |
221 |
◊ |
[B12]A:800 |
x,y,z |
1_555 |
19 |
1 |
1497 |
63.3 |
-0.6 |
0.526 |
0 |
0 |
0 |
0.030 |
24 |
|
[GOL]C:802 |
5 |
1 |
223 |
◊ |
[B12]C:800 |
x,y,z |
1_555 |
17 |
1 |
1506 |
61.7 |
-0.5 |
0.482 |
0 |
0 |
0 |
0.030 |
| Average: |
62.5 |
-0.5 |
0.504 |
0 |
0 |
0 |
0.030 |
| 18 |
25 |
|
C |
10 |
4 |
29620 |
◊ |
A |
x-1,y,z |
1_455 |
11 |
3 |
29735 |
62.9 |
0.3 |
0.734 |
1 |
1 |
0 |
0.000 |
| 19 |
26 |
|
[DCA]C:801 |
8 |
1 |
918 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
26857 |
62.5 |
1.5 |
0.705 |
0 |
0 |
0 |
0.000 |
27 |
|
[DCA]A:801 |
7 |
1 |
920 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
26710 |
62.2 |
1.2 |
0.675 |
0 |
0 |
0 |
0.000 |
| Average: |
62.3 |
1.3 |
0.690 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
C |
4 |
1 |
29620 |
◊ |
D |
x,y,z-1 |
1_554 |
6 |
2 |
26857 |
57.7 |
-1.1 |
0.197 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
B |
6 |
1 |
26710 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
6 |
2 |
26857 |
53.2 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
30 |
|
B |
5 |
1 |
26710 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
7 |
2 |
26857 |
48.7 |
0.3 |
0.763 |
0 |
0 |
0 |
0.000 |
| Average: |
51.0 |
0.2 |
0.711 |
0 |
0 |
0 |
0.000 |
| 22 |
31 |
|
B |
4 |
2 |
26710 |
◊ |
C |
x,y,z-1 |
1_554 |
4 |
1 |
29620 |
45.3 |
-1.0 |
0.229 |
0 |
0 |
0 |
0.000 |
| 23 |
32 |
|
A |
5 |
2 |
29735 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
5 |
2 |
26857 |
42.9 |
-0.5 |
0.400 |
0 |
0 |
0 |
0.000 |
| 24 |
33 |
|
[GOL]C:802 |
3 |
1 |
223 |
f |
[DCA]C:801 |
x,y,z |
1_555 |
1 |
1 |
918 |
18.5 |
0.8 |
0.643 |
0 |
0 |
0 |
0.000 |
34 |
|
[GOL]A:802 |
1 |
1 |
221 |
f |
[DCA]A:801 |
x,y,z |
1_555 |
1 |
1 |
920 |
17.8 |
0.8 |
0.634 |
0 |
0 |
0 |
0.000 |
| Average: |
18.1 |
0.8 |
0.639 |
0 |
0 |
0 |
0.000 |
| 25 |
35 |
|
B |
2 |
2 |
26710 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
2 |
2 |
26857 |
7.6 |
-0.0 |
0.557 |
0 |
0 |
0 |
0.000 |
| 26 |
36 |
|
A |
1 |
1 |
29735 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
1 |
1 |
29620 |
2.7 |
-0.0 |
0.549 |
0 |
0 |
0 |
0.000 |
|