| ## |
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 |
|
[HEC]B:201 |
43 |
1 |
839 |
cf |
B |
x,y,z |
1_555 |
80 |
32 |
6063 |
579.3 |
-22.9 |
0.228 |
8 |
0 |
0 |
0.100 |
2 |
|
[HEC]D:201 |
43 |
1 |
840 |
f |
D |
x,y,z |
1_555 |
82 |
32 |
6171 |
579.2 |
-22.9 |
0.264 |
8 |
0 |
0 |
0.100 |
3 |
|
[HEC]A:201 |
43 |
1 |
839 |
f |
A |
x,y,z |
1_555 |
79 |
32 |
6201 |
576.4 |
-22.9 |
0.217 |
8 |
0 |
0 |
0.100 |
4 |
|
[HEC]C:201 |
43 |
1 |
839 |
f |
C |
x,y,z |
1_555 |
81 |
31 |
6124 |
574.9 |
-22.8 |
0.226 |
8 |
0 |
0 |
0.100 |
| Average: |
577.5 |
-22.9 |
0.234 |
8 |
0 |
0 |
0.100 |
| 2 |
5 |
|
B |
52 |
15 |
6063 |
◊ |
D |
x,y,z-1 |
1_554 |
54 |
15 |
6171 |
470.8 |
-2.2 |
0.468 |
3 |
1 |
0 |
0.000 |
6 |
|
C |
52 |
17 |
6124 |
◊ |
A |
x-1,y-1,z |
1_445 |
50 |
14 |
6201 |
463.0 |
-0.7 |
0.534 |
6 |
1 |
0 |
0.000 |
| Average: |
466.9 |
-1.5 |
0.501 |
5 |
1 |
0 |
0.000 |
| 3 |
7 |
|
C |
46 |
15 |
6124 |
◊ |
B |
x,y,z |
1_555 |
43 |
14 |
6063 |
469.7 |
-2.4 |
0.369 |
1 |
0 |
0 |
0.000 |
8 |
|
D |
38 |
13 |
6171 |
◊ |
A |
x,y,z |
1_555 |
41 |
14 |
6201 |
449.8 |
-2.1 |
0.365 |
3 |
0 |
0 |
0.000 |
| Average: |
459.7 |
-2.2 |
0.367 |
2 |
0 |
0 |
0.000 |
| 4 |
9 |
|
D |
25 |
8 |
6171 |
◊ |
C |
x,y,z |
1_555 |
22 |
7 |
6124 |
210.8 |
-5.2 |
0.101 |
2 |
0 |
0 |
0.000 |
| 5 |
10 |
|
A |
23 |
8 |
6201 |
x |
A |
x-1,y,z |
1_455 |
22 |
6 |
6201 |
186.0 |
-1.9 |
0.375 |
1 |
0 |
0 |
0.000 |
| 6 |
11 |
|
B |
22 |
8 |
6063 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
6201 |
174.1 |
0.8 |
0.689 |
4 |
0 |
0 |
0.000 |
| 7 |
12 |
|
C |
15 |
5 |
6124 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
4 |
6171 |
135.3 |
-0.0 |
0.575 |
1 |
2 |
0 |
0.000 |
| 8 |
13 |
|
D |
14 |
4 |
6171 |
x |
D |
x-1,y,z |
1_455 |
12 |
4 |
6171 |
121.4 |
-1.2 |
0.413 |
1 |
1 |
0 |
0.000 |
| 9 |
14 |
|
[FC6]C:202 |
8 |
1 |
374 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
15 |
6 |
6171 |
120.7 |
-0.6 |
0.518 |
0 |
0 |
0 |
0.000 |
| 10 |
15 |
|
[FC6]C:202 |
8 |
1 |
374 |
f |
C |
x,y,z |
1_555 |
16 |
6 |
6124 |
119.5 |
-1.1 |
0.489 |
0 |
0 |
0 |
0.004 |
| 11 |
16 |
|
[FC6]B:202 |
8 |
1 |
373 |
f |
A |
x-1,y-1,z-1 |
1_444 |
16 |
5 |
6201 |
118.3 |
-2.2 |
0.373 |
0 |
0 |
0 |
0.008 |
| 12 |
17 |
|
[FC6]B:202 |
8 |
1 |
373 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
6063 |
117.0 |
0.2 |
0.478 |
0 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[FC6]B:203 |
8 |
1 |
377 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
6063 |
116.6 |
-1.3 |
0.503 |
0 |
0 |
0 |
0.005 |
| 14 |
19 |
|
[FC6]B:203 |
8 |
1 |
377 |
◊ |
D |
x-1,y,z-1 |
1_454 |
16 |
5 |
6171 |
110.6 |
1.1 |
0.575 |
0 |
0 |
0 |
0.000 |
| 15 |
20 |
|
B |
12 |
3 |
6063 |
x |
B |
x-1,y,z |
1_455 |
13 |
5 |
6063 |
101.3 |
-1.0 |
0.399 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
C |
14 |
4 |
6124 |
◊ |
B |
x,y-1,z |
1_545 |
9 |
2 |
6063 |
98.2 |
0.4 |
0.644 |
1 |
2 |
0 |
0.000 |
| 17 |
22 |
|
B |
9 |
3 |
6063 |
◊ |
D |
x-1,y,z-1 |
1_454 |
14 |
6 |
6171 |
97.1 |
1.0 |
0.710 |
1 |
2 |
0 |
0.000 |
| 18 |
23 |
|
[FC6]B:203 |
8 |
1 |
377 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
5 |
6063 |
92.0 |
-0.7 |
0.563 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
C |
10 |
2 |
6124 |
◊ |
A |
x,y-1,z |
1_545 |
13 |
3 |
6201 |
88.8 |
-0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
| 20 |
25 |
|
C |
13 |
5 |
6124 |
◊ |
B |
x-1,y,z |
1_455 |
10 |
4 |
6063 |
85.2 |
-1.5 |
0.351 |
0 |
0 |
0 |
0.000 |
| 21 |
26 |
|
C |
10 |
4 |
6124 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
3 |
6201 |
80.8 |
1.6 |
0.751 |
1 |
0 |
0 |
0.000 |
| 22 |
27 |
|
B |
9 |
4 |
6063 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
3 |
6201 |
78.3 |
0.4 |
0.565 |
1 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[HEC]C:201 |
3 |
1 |
839 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
6063 |
53.9 |
-1.4 |
0.446 |
0 |
0 |
0 |
0.000 |
29 |
|
[HEC]D:201 |
3 |
1 |
840 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
6201 |
50.1 |
-1.4 |
0.379 |
0 |
0 |
0 |
0.000 |
30 |
|
[HEC]B:201 |
3 |
1 |
839 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
6124 |
50.0 |
-1.3 |
0.451 |
0 |
0 |
0 |
0.000 |
| Average: |
51.4 |
-1.4 |
0.425 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
[HEC]A:201 |
3 |
1 |
839 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
6171 |
52.1 |
-1.4 |
0.453 |
0 |
0 |
0 |
0.000 |
| 25 |
32 |
|
D |
3 |
2 |
6171 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
2 |
6201 |
34.4 |
-0.7 |
0.308 |
0 |
0 |
0 |
0.000 |
| 26 |
33 |
|
C |
2 |
1 |
6124 |
◊ |
D |
x,y-1,z-1 |
1_544 |
4 |
2 |
6171 |
21.4 |
1.0 |
0.818 |
1 |
1 |
0 |
0.000 |
| 27 |
34 |
|
[HEC]C:201 |
1 |
1 |
839 |
◊ |
[HEC]B:201 |
x,y,z |
1_555 |
1 |
1 |
839 |
20.2 |
-0.6 |
0.430 |
0 |
0 |
0 |
0.000 |
35 |
|
[HEC]D:201 |
1 |
1 |
840 |
◊ |
[HEC]A:201 |
x,y,z |
1_555 |
1 |
1 |
839 |
19.0 |
-0.6 |
0.442 |
0 |
0 |
0 |
0.000 |
| Average: |
19.6 |
-0.6 |
0.436 |
0 |
0 |
0 |
0.000 |
| 28 |
36 |
|
B |
2 |
2 |
6063 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
2 |
2 |
6201 |
16.0 |
-0.2 |
0.449 |
0 |
0 |
0 |
0.000 |
| 29 |
37 |
|
D |
3 |
2 |
6171 |
◊ |
A |
x,y-1,z |
1_545 |
2 |
1 |
6201 |
15.5 |
0.2 |
0.726 |
0 |
0 |
0 |
0.000 |
| 30 |
38 |
|
C |
1 |
1 |
6124 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
1 |
1 |
6171 |
15.2 |
1.1 |
0.943 |
0 |
0 |
0 |
0.000 |
| 31 |
39 |
|
C |
1 |
1 |
6124 |
x |
C |
x-1,y,z |
1_455 |
1 |
1 |
6124 |
3.3 |
0.2 |
0.782 |
0 |
0 |
0 |
0.000 |
| 32 |
40 |
|
B |
1 |
1 |
6063 |
◊ |
D |
x,y-1,z-1 |
1_544 |
1 |
1 |
6171 |
1.2 |
-0.0 |
0.544 |
0 |
0 |
0 |
0.000 |
|