## |
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 |
|
A |
83 |
21 |
9584 |
◊ |
H |
x-1,y,z-1 |
1_454 |
81 |
22 |
9590 |
725.2 |
-3.3 |
0.477 |
9 |
0 |
0 |
0.000 |
2 |
|
B |
72 |
19 |
9682 |
◊ |
G |
x,y,z-1 |
1_554 |
77 |
19 |
9514 |
712.6 |
-3.2 |
0.438 |
13 |
1 |
0 |
0.000 |
3 |
|
E |
71 |
19 |
9547 |
◊ |
D |
x-1,y,z |
1_455 |
70 |
18 |
9598 |
647.6 |
-1.9 |
0.552 |
9 |
0 |
0 |
0.000 |
4 |
|
F |
71 |
20 |
9557 |
◊ |
C |
x,y,z |
1_555 |
67 |
19 |
9524 |
627.3 |
-2.8 |
0.469 |
7 |
0 |
0 |
0.000 |
Average: |
678.2 |
-2.8 |
0.484 |
10 |
0 |
0 |
0.000 |
2 |
5 |
|
B |
70 |
17 |
9682 |
◊ |
A |
x,y,z |
1_555 |
71 |
17 |
9584 |
671.8 |
-7.7 |
0.159 |
5 |
0 |
1 |
1.000 |
3 |
6 |
|
C |
70 |
21 |
9524 |
◊ |
D |
x-1,y,z |
1_455 |
72 |
22 |
9598 |
630.3 |
-2.3 |
0.511 |
4 |
0 |
0 |
0.000 |
7 |
|
G |
69 |
21 |
9514 |
◊ |
H |
x-1,y,z |
1_455 |
69 |
20 |
9590 |
622.7 |
-2.7 |
0.475 |
5 |
0 |
0 |
0.000 |
8 |
|
E |
66 |
19 |
9547 |
◊ |
F |
x-1,y,z |
1_455 |
66 |
20 |
9557 |
602.5 |
-2.4 |
0.487 |
5 |
0 |
0 |
0.000 |
Average: |
618.5 |
-2.5 |
0.491 |
5 |
0 |
0 |
0.000 |
4 |
9 |
|
E |
53 |
16 |
9547 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
51 |
15 |
9682 |
585.7 |
-5.4 |
0.215 |
3 |
0 |
0 |
0.000 |
10 |
|
C |
50 |
16 |
9524 |
◊ |
A |
x,y,z |
1_555 |
51 |
16 |
9584 |
515.8 |
-6.4 |
0.146 |
1 |
0 |
0 |
0.000 |
Average: |
550.8 |
-5.9 |
0.181 |
2 |
0 |
0 |
0.000 |
5 |
11 |
|
H |
47 |
15 |
9590 |
◊ |
G |
x,y,z |
1_555 |
45 |
16 |
9514 |
479.8 |
-5.3 |
0.200 |
1 |
0 |
0 |
0.000 |
6 |
12 |
|
C |
48 |
13 |
9524 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
41 |
14 |
9514 |
454.6 |
-4.3 |
0.135 |
3 |
2 |
0 |
0.000 |
7 |
13 |
|
[YFG]A:1901 |
27 |
1 |
611 |
◊ |
A |
x,y,z |
1_555 |
67 |
20 |
9584 |
421.3 |
2.5 |
0.415 |
5 |
0 |
0 |
0.000 |
14 |
|
[YFG]B:1901 |
27 |
1 |
611 |
◊ |
B |
x,y,z |
1_555 |
68 |
20 |
9682 |
420.6 |
2.5 |
0.412 |
5 |
0 |
0 |
0.000 |
15 |
|
[YFG]E:1901 |
27 |
1 |
606 |
◊ |
E |
x,y,z |
1_555 |
70 |
21 |
9547 |
420.0 |
2.3 |
0.421 |
6 |
0 |
0 |
0.000 |
16 |
|
[YFG]F:1901 |
27 |
1 |
609 |
◊ |
F |
x,y,z |
1_555 |
66 |
21 |
9557 |
417.5 |
2.7 |
0.442 |
5 |
0 |
0 |
0.000 |
17 |
|
[YFG]H:1901 |
27 |
1 |
613 |
◊ |
H |
x,y,z |
1_555 |
67 |
21 |
9590 |
413.6 |
3.1 |
0.478 |
5 |
0 |
0 |
0.000 |
18 |
|
[YFG]C:1901 |
27 |
1 |
611 |
◊ |
C |
x,y,z |
1_555 |
70 |
20 |
9524 |
412.4 |
2.8 |
0.439 |
5 |
0 |
0 |
0.000 |
19 |
|
[YFG]D:1901 |
27 |
1 |
606 |
◊ |
D |
x,y,z |
1_555 |
67 |
21 |
9598 |
408.4 |
2.2 |
0.402 |
6 |
0 |
0 |
0.000 |
20 |
|
[YFG]G:1901 |
27 |
1 |
611 |
◊ |
G |
x,y,z |
1_555 |
69 |
21 |
9514 |
408.4 |
2.1 |
0.356 |
6 |
0 |
0 |
0.000 |
Average: |
415.3 |
2.5 |
0.421 |
5 |
0 |
0 |
0.000 |
8 |
21 |
|
D |
44 |
13 |
9598 |
◊ |
B |
x,y,z |
1_555 |
45 |
14 |
9682 |
386.5 |
-2.0 |
0.463 |
9 |
0 |
0 |
0.000 |
22 |
|
F |
44 |
14 |
9557 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
47 |
15 |
9584 |
374.8 |
-2.1 |
0.460 |
8 |
0 |
0 |
0.000 |
Average: |
380.6 |
-2.0 |
0.461 |
9 |
0 |
0 |
0.000 |
9 |
23 |
|
D |
40 |
12 |
9598 |
◊ |
C |
x,y,z |
1_555 |
38 |
12 |
9524 |
352.9 |
-4.6 |
0.213 |
4 |
2 |
0 |
0.315 |
24 |
|
F |
39 |
12 |
9557 |
◊ |
E |
x,y,z |
1_555 |
36 |
12 |
9547 |
348.1 |
-4.9 |
0.182 |
5 |
2 |
0 |
0.315 |
Average: |
350.5 |
-4.8 |
0.197 |
5 |
2 |
0 |
0.315 |
10 |
25 |
|
E |
38 |
14 |
9547 |
◊ |
H |
x-1,y,z |
1_455 |
33 |
12 |
9590 |
323.7 |
-5.2 |
0.108 |
1 |
0 |
0 |
0.000 |
11 |
26 |
|
C |
16 |
5 |
9524 |
◊ |
E |
x,y,z-1 |
1_554 |
16 |
6 |
9547 |
173.7 |
-1.3 |
0.375 |
0 |
0 |
0 |
0.000 |
27 |
|
G |
17 |
6 |
9514 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
9584 |
165.1 |
-0.7 |
0.432 |
0 |
0 |
0 |
0.000 |
Average: |
169.4 |
-1.0 |
0.403 |
0 |
0 |
0 |
0.000 |
12 |
28 |
|
A |
19 |
5 |
9584 |
◊ |
E |
x,y,z-1 |
1_554 |
18 |
5 |
9547 |
161.6 |
0.6 |
0.551 |
2 |
0 |
0 |
0.000 |
13 |
29 |
|
F |
20 |
4 |
9557 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
12 |
4 |
9682 |
131.3 |
-2.2 |
0.267 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
11 |
4 |
9584 |
◊ |
D |
x-1,y,z |
1_455 |
19 |
3 |
9598 |
126.4 |
-2.2 |
0.252 |
1 |
0 |
0 |
0.000 |
Average: |
128.8 |
-2.2 |
0.259 |
1 |
0 |
0 |
0.000 |
14 |
31 |
|
G |
19 |
7 |
9514 |
◊ |
F |
x,y,z |
1_555 |
9 |
4 |
9557 |
128.4 |
-1.4 |
0.223 |
0 |
0 |
0 |
0.000 |
15 |
32 |
|
[GOL]F:1902 |
6 |
1 |
221 |
◊ |
F |
x,y,z |
1_555 |
30 |
8 |
9557 |
126.2 |
-0.7 |
0.487 |
2 |
0 |
0 |
0.067 |
16 |
33 |
|
[GOL]H:1902 |
6 |
1 |
222 |
f |
H |
x,y,z |
1_555 |
30 |
8 |
9590 |
112.9 |
-0.9 |
0.495 |
0 |
0 |
0 |
0.054 |
17 |
34 |
|
H |
13 |
6 |
9590 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
9682 |
110.0 |
-1.0 |
0.356 |
0 |
0 |
0 |
0.000 |
18 |
35 |
|
A |
13 |
6 |
9584 |
◊ |
B |
x-1,y,z |
1_455 |
13 |
6 |
9682 |
101.4 |
1.4 |
0.795 |
3 |
0 |
0 |
0.000 |
19 |
36 |
|
G |
9 |
3 |
9514 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
9524 |
75.9 |
0.9 |
0.757 |
1 |
0 |
0 |
0.000 |
37 |
|
C |
6 |
3 |
9524 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
4 |
2 |
9682 |
20.8 |
0.5 |
0.726 |
0 |
0 |
0 |
0.000 |
Average: |
48.4 |
0.7 |
0.741 |
1 |
0 |
0 |
0.000 |
20 |
38 |
|
E |
7 |
1 |
9547 |
◊ |
H |
-x+1,y-1/2,-z+1 |
2_646 |
11 |
4 |
9590 |
70.0 |
1.3 |
0.817 |
2 |
0 |
0 |
0.000 |
21 |
39 |
|
E |
8 |
3 |
9547 |
◊ |
G |
-x+1,y-1/2,-z+2 |
2_647 |
6 |
1 |
9514 |
58.0 |
0.8 |
0.734 |
1 |
0 |
0 |
0.000 |
22 |
40 |
|
[YFG]G:1901 |
4 |
1 |
611 |
f |
H |
x-1,y,z |
1_455 |
10 |
4 |
9590 |
55.9 |
-0.8 |
0.241 |
0 |
0 |
0 |
0.100 |
41 |
|
[YFG]C:1901 |
4 |
1 |
611 |
f |
D |
x-1,y,z |
1_455 |
8 |
3 |
9598 |
51.7 |
-0.6 |
0.271 |
0 |
0 |
0 |
0.100 |
42 |
|
G |
8 |
3 |
9514 |
f |
[YFG]H:1901 |
x-1,y,z |
1_455 |
4 |
1 |
613 |
50.6 |
-0.6 |
0.285 |
0 |
0 |
0 |
0.100 |
43 |
|
C |
4 |
2 |
9524 |
f |
[YFG]D:1901 |
x-1,y,z |
1_455 |
4 |
1 |
606 |
48.7 |
-0.6 |
0.291 |
0 |
0 |
0 |
0.100 |
44 |
|
[YFG]E:1901 |
4 |
1 |
606 |
f |
F |
x-1,y,z |
1_455 |
5 |
2 |
9557 |
46.4 |
-0.6 |
0.293 |
0 |
0 |
0 |
0.100 |
45 |
|
E |
5 |
3 |
9547 |
f |
[YFG]F:1901 |
x-1,y,z |
1_455 |
4 |
1 |
609 |
45.0 |
-0.4 |
0.315 |
0 |
0 |
0 |
0.100 |
Average: |
49.7 |
-0.6 |
0.283 |
0 |
0 |
0 |
0.100 |
23 |
46 |
|
[CL]E:1902 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
18 |
5 |
9547 |
51.7 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.277 |
24 |
47 |
|
C |
7 |
3 |
9524 |
◊ |
H |
x-1,y,z-1 |
1_454 |
5 |
1 |
9590 |
50.9 |
0.7 |
0.750 |
1 |
0 |
0 |
0.000 |
48 |
|
D |
1 |
1 |
9598 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
9682 |
0.5 |
-0.0 |
0.600 |
0 |
0 |
0 |
0.000 |
Average: |
25.7 |
0.3 |
0.675 |
1 |
0 |
0 |
0.000 |
25 |
49 |
|
C |
8 |
3 |
9524 |
◊ |
H |
-x+2,y-1/2,-z+1 |
2_746 |
5 |
1 |
9590 |
49.3 |
-0.6 |
0.400 |
0 |
0 |
0 |
0.000 |
26 |
50 |
|
[CL]E:1902 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
8 |
3 |
9557 |
44.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.228 |
27 |
51 |
|
[GOL]F:1902 |
5 |
1 |
221 |
f |
E |
x,y,z |
1_555 |
6 |
2 |
9547 |
39.6 |
0.2 |
0.632 |
0 |
0 |
0 |
0.000 |
28 |
52 |
|
[YFG]C:1901 |
6 |
1 |
611 |
◊ |
[YFG]D:1901 |
x-1,y,z |
1_455 |
6 |
1 |
606 |
37.3 |
-0.3 |
0.215 |
0 |
0 |
0 |
0.000 |
53 |
|
[YFG]E:1901 |
5 |
1 |
606 |
◊ |
[YFG]F:1901 |
x-1,y,z |
1_455 |
5 |
1 |
609 |
34.3 |
-0.4 |
0.222 |
0 |
0 |
0 |
0.000 |
54 |
|
[YFG]G:1901 |
6 |
1 |
611 |
◊ |
[YFG]H:1901 |
x-1,y,z |
1_455 |
6 |
1 |
613 |
33.3 |
0.0 |
0.247 |
0 |
0 |
0 |
0.000 |
Average: |
34.9 |
-0.2 |
0.228 |
0 |
0 |
0 |
0.000 |
29 |
55 |
|
[GOL]H:1902 |
3 |
1 |
222 |
◊ |
G |
x,y,z |
1_555 |
8 |
3 |
9514 |
29.1 |
0.4 |
0.622 |
0 |
0 |
0 |
0.000 |
30 |
56 |
|
D |
1 |
1 |
9598 |
◊ |
H |
-x+2,y-1/2,-z+1 |
2_746 |
2 |
1 |
9590 |
28.1 |
-0.9 |
0.095 |
0 |
0 |
0 |
0.000 |
31 |
57 |
|
[GOL]F:1902 |
3 |
1 |
221 |
f |
[CL]E:1902 |
x,y,z |
1_555 |
1 |
1 |
125 |
18.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.082 |
32 |
58 |
|
F |
1 |
1 |
9557 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9584 |
2.6 |
-0.0 |
0.555 |
0 |
0 |
0 |
0.000 |
33 |
59 |
|
D |
1 |
1 |
9598 |
◊ |
G |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
9514 |
0.7 |
0.0 |
0.620 |
0 |
0 |
0 |
0.000 |
34 |
60 |
|
[YFG]C:1901 |
1 |
1 |
611 |
◊ |
E |
x,y,z-1 |
1_554 |
1 |
1 |
9547 |
0.1 |
0.0 |
0.559 |
0 |
0 |
0 |
0.000 |
|