## |
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 |
|
B |
143 |
34 |
6603 |
◊ |
A |
x,y,z |
1_555 |
147 |
44 |
15407 |
1381.9 |
-10.0 |
0.250 |
22 |
6 |
0 |
0.902 |
2 |
|
E |
139 |
34 |
6763 |
◊ |
D |
x,y,z |
1_555 |
152 |
45 |
15250 |
1366.7 |
-10.9 |
0.175 |
20 |
4 |
0 |
0.902 |
Average: |
1374.3 |
-10.4 |
0.212 |
21 |
5 |
0 |
0.902 |
2 |
3 |
|
C |
72 |
8 |
1390 |
◊ |
A |
x,y,z |
1_555 |
135 |
40 |
15407 |
947.2 |
-12.2 |
0.244 |
15 |
2 |
0 |
0.919 |
4 |
|
F |
72 |
8 |
1375 |
◊ |
D |
x,y,z |
1_555 |
133 |
39 |
15250 |
932.6 |
-12.1 |
0.246 |
15 |
1 |
0 |
0.919 |
Average: |
939.9 |
-12.2 |
0.245 |
15 |
2 |
0 |
0.919 |
3 |
5 |
|
G |
101 |
28 |
15841 |
◊ |
A |
x,y,z |
1_555 |
97 |
22 |
15407 |
856.1 |
-8.2 |
0.235 |
8 |
3 |
0 |
0.326 |
6 |
|
H |
105 |
29 |
15136 |
◊ |
D |
x,y,z |
1_555 |
90 |
22 |
15250 |
850.5 |
-7.1 |
0.317 |
10 |
6 |
0 |
0.326 |
Average: |
853.3 |
-7.7 |
0.276 |
9 |
5 |
0 |
0.326 |
4 |
7 |
|
G |
71 |
24 |
15841 |
◊ |
D |
x,y,z-1 |
1_554 |
73 |
24 |
15250 |
666.9 |
-3.8 |
0.314 |
7 |
1 |
0 |
0.000 |
5 |
8 |
|
A |
69 |
23 |
15407 |
◊ |
H |
x-1,y-1,z |
1_445 |
61 |
22 |
15136 |
579.9 |
-4.3 |
0.297 |
3 |
1 |
0 |
0.000 |
6 |
9 |
|
A |
54 |
15 |
15407 |
◊ |
H |
x,y-1,z |
1_545 |
67 |
21 |
15136 |
528.3 |
-0.1 |
0.564 |
4 |
8 |
0 |
0.121 |
10 |
|
G |
58 |
20 |
15841 |
◊ |
D |
x-1,y,z-1 |
1_454 |
51 |
15 |
15250 |
522.3 |
0.5 |
0.640 |
9 |
8 |
0 |
0.121 |
Average: |
525.3 |
0.2 |
0.602 |
7 |
8 |
0 |
0.121 |
7 |
11 |
|
H |
36 |
12 |
15136 |
◊ |
B |
x,y,z |
1_555 |
36 |
12 |
6603 |
370.9 |
-0.8 |
0.613 |
5 |
0 |
0 |
0.000 |
8 |
12 |
|
G |
43 |
15 |
15841 |
◊ |
A |
x,y,z-1 |
1_554 |
43 |
15 |
15407 |
346.3 |
-2.2 |
0.454 |
2 |
0 |
0 |
0.095 |
13 |
|
H |
38 |
14 |
15136 |
◊ |
D |
x,y,z-1 |
1_554 |
42 |
14 |
15250 |
326.8 |
-2.8 |
0.388 |
2 |
1 |
0 |
0.095 |
Average: |
336.6 |
-2.5 |
0.421 |
2 |
1 |
0 |
0.095 |
9 |
14 |
|
G |
29 |
11 |
15841 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
27 |
9 |
6763 |
267.9 |
0.0 |
0.635 |
2 |
0 |
0 |
0.000 |
10 |
15 |
|
[NAG]G:400 |
13 |
1 |
363 |
cf |
G |
x,y,z |
1_555 |
17 |
9 |
15841 |
164.2 |
3.5 |
0.336 |
1 |
0 |
0 |
0.000 |
16 |
|
[NAG]H:400 |
13 |
1 |
364 |
cf |
H |
x,y,z |
1_555 |
20 |
9 |
15136 |
161.3 |
3.5 |
0.361 |
1 |
0 |
0 |
0.000 |
Average: |
162.7 |
3.5 |
0.349 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
[NAG]G:401 |
11 |
1 |
355 |
cf |
G |
x,y,z |
1_555 |
21 |
6 |
15841 |
155.1 |
5.1 |
0.594 |
2 |
0 |
0 |
0.000 |
12 |
18 |
|
G |
17 |
5 |
15841 |
◊ |
A |
x-1,y,z |
1_455 |
19 |
8 |
15407 |
145.4 |
1.3 |
0.632 |
2 |
0 |
0 |
0.000 |
13 |
19 |
|
[NAG]H:401 |
11 |
1 |
351 |
cf |
H |
x,y,z |
1_555 |
19 |
6 |
15136 |
135.2 |
4.1 |
0.432 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
[NAG]G:402 |
10 |
1 |
354 |
cf |
G |
x,y,z |
1_555 |
17 |
7 |
15841 |
129.9 |
2.8 |
0.366 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
H |
19 |
6 |
15136 |
◊ |
D |
x-1,y,z |
1_455 |
13 |
5 |
15250 |
124.7 |
0.2 |
0.634 |
1 |
0 |
0 |
0.000 |
16 |
22 |
|
[ACT]D:302 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
20 |
6 |
15250 |
96.7 |
-1.0 |
0.541 |
0 |
0 |
0 |
0.044 |
17 |
23 |
|
[ACT]D:301 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
15250 |
92.7 |
-0.9 |
0.532 |
0 |
0 |
0 |
0.040 |
18 |
24 |
|
[FMT]A:301 |
3 |
1 |
149 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
15407 |
92.5 |
-0.1 |
0.595 |
0 |
0 |
0 |
0.002 |
19 |
25 |
|
[ACT]A:302 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
21 |
10 |
6603 |
92.1 |
-0.1 |
0.714 |
1 |
0 |
0 |
0.024 |
20 |
26 |
|
[ACT]E:101 |
4 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
18 |
8 |
6763 |
84.0 |
0.1 |
0.678 |
1 |
0 |
0 |
0.015 |
21 |
27 |
|
A |
13 |
4 |
15407 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
4 |
15250 |
83.6 |
1.6 |
0.762 |
1 |
3 |
0 |
0.000 |
28 |
|
A |
9 |
3 |
15407 |
◊ |
D |
x,y-1,z-1 |
1_544 |
12 |
4 |
15250 |
81.5 |
0.2 |
0.475 |
1 |
1 |
0 |
0.000 |
Average: |
82.5 |
0.9 |
0.618 |
1 |
2 |
0 |
0.000 |
22 |
29 |
|
G |
13 |
8 |
15841 |
◊ |
H |
x-1,y-1,z-1 |
1_444 |
11 |
4 |
15136 |
82.2 |
-0.4 |
0.559 |
0 |
0 |
0 |
0.000 |
30 |
|
H |
7 |
5 |
15136 |
◊ |
G |
x,y,z |
1_555 |
8 |
2 |
15841 |
34.0 |
0.3 |
0.677 |
0 |
0 |
0 |
0.000 |
Average: |
58.1 |
-0.1 |
0.618 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
[ACT]E:101 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
15250 |
73.2 |
-1.5 |
0.367 |
1 |
0 |
0 |
0.084 |
24 |
32 |
|
[ACT]A:302 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
15407 |
69.7 |
-1.2 |
0.410 |
1 |
0 |
0 |
0.100 |
25 |
33 |
|
[ACT]E:102 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
11 |
6 |
15250 |
67.4 |
0.5 |
0.708 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
G |
13 |
5 |
15841 |
x |
G |
x-1,y,z |
1_455 |
7 |
3 |
15841 |
58.4 |
-0.1 |
0.632 |
0 |
0 |
0 |
0.000 |
27 |
35 |
|
G |
9 |
4 |
15841 |
◊ |
[ACT]D:302 |
x-1,y,z-1 |
1_454 |
4 |
1 |
183 |
56.9 |
-0.5 |
0.521 |
0 |
0 |
0 |
0.014 |
28 |
36 |
|
[ACT]E:102 |
2 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
11 |
3 |
6763 |
55.0 |
-0.5 |
0.552 |
1 |
0 |
0 |
0.100 |
29 |
37 |
|
G |
5 |
5 |
15841 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
1390 |
42.6 |
-0.2 |
0.628 |
0 |
0 |
0 |
0.001 |
38 |
|
H |
5 |
5 |
15136 |
◊ |
F |
x,y,z |
1_555 |
7 |
3 |
1375 |
38.3 |
-0.1 |
0.662 |
0 |
0 |
0 |
0.001 |
Average: |
40.4 |
-0.2 |
0.645 |
0 |
0 |
0 |
0.001 |
30 |
39 |
|
[ACT]E:102 |
2 |
1 |
184 |
◊ |
[ACT]D:301 |
x,y,z |
1_555 |
3 |
1 |
184 |
32.9 |
-0.2 |
0.661 |
0 |
0 |
0 |
0.008 |
31 |
40 |
|
[NAG]G:401 |
6 |
1 |
355 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
1 |
15407 |
30.6 |
0.3 |
0.235 |
0 |
0 |
0 |
0.000 |
32 |
41 |
|
[NAG]H:401 |
5 |
1 |
351 |
◊ |
D |
x,y,z-1 |
1_554 |
4 |
1 |
15250 |
28.9 |
0.1 |
0.188 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
H |
5 |
2 |
15136 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
6763 |
27.7 |
0.2 |
0.681 |
0 |
0 |
0 |
0.001 |
43 |
|
G |
2 |
1 |
15841 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
6603 |
25.0 |
-0.3 |
0.461 |
0 |
0 |
0 |
0.001 |
Average: |
26.3 |
-0.0 |
0.571 |
0 |
0 |
0 |
0.001 |
34 |
44 |
|
[ACT]D:301 |
1 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
5 |
3 |
6763 |
26.7 |
0.5 |
0.831 |
1 |
0 |
0 |
0.000 |
35 |
45 |
|
G |
3 |
1 |
15841 |
◊ |
[NAG]G:401 |
x-1,y,z |
1_455 |
1 |
1 |
355 |
23.7 |
1.1 |
0.790 |
0 |
0 |
0 |
0.000 |
36 |
46 |
|
A |
5 |
2 |
15407 |
◊ |
D |
x-1,y,z-1 |
1_454 |
5 |
1 |
15250 |
23.1 |
-0.1 |
0.531 |
0 |
0 |
0 |
0.000 |
47 |
|
A |
2 |
1 |
15407 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
15250 |
9.1 |
-0.3 |
0.279 |
0 |
0 |
0 |
0.000 |
Average: |
16.1 |
-0.2 |
0.405 |
0 |
0 |
0 |
0.000 |
37 |
48 |
|
C |
1 |
1 |
1390 |
◊ |
D |
x,y-1,z-1 |
1_544 |
3 |
2 |
15250 |
19.7 |
0.2 |
0.695 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
B |
2 |
2 |
6603 |
◊ |
H |
x,y-1,z |
1_545 |
2 |
2 |
15136 |
19.4 |
1.0 |
0.904 |
0 |
0 |
0 |
0.000 |
39 |
50 |
|
[FMT]A:301 |
2 |
1 |
149 |
f |
H |
x,y-1,z |
1_545 |
2 |
1 |
15136 |
14.2 |
-0.1 |
0.496 |
0 |
0 |
0 |
0.003 |
40 |
51 |
|
H |
2 |
1 |
15136 |
◊ |
[NAG]H:401 |
x-1,y,z |
1_455 |
1 |
1 |
351 |
9.8 |
0.2 |
0.427 |
0 |
0 |
0 |
0.000 |
|