## |
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 |
|
H |
267 |
76 |
20026 |
◊ |
G |
x,y,z |
1_555 |
273 |
78 |
19956 |
2708.2 |
-25.2 |
0.040 |
53 |
8 |
0 |
0.441 |
2 |
|
B |
271 |
78 |
19802 |
◊ |
A |
x,y,z |
1_555 |
273 |
78 |
19838 |
2694.0 |
-24.4 |
0.053 |
50 |
7 |
0 |
0.441 |
3 |
|
F |
265 |
77 |
19969 |
◊ |
E |
x,y,z |
1_555 |
268 |
81 |
19779 |
2672.1 |
-25.9 |
0.033 |
49 |
6 |
0 |
0.441 |
4 |
|
D |
268 |
78 |
19772 |
◊ |
C |
x,y,z |
1_555 |
268 |
77 |
19791 |
2667.6 |
-24.2 |
0.053 |
47 |
6 |
0 |
0.441 |
Average: |
2685.5 |
-24.9 |
0.044 |
50 |
7 |
0 |
0.441 |
2 |
5 |
|
G |
169 |
45 |
19956 |
◊ |
F |
x,y,z |
1_555 |
168 |
46 |
19969 |
1517.7 |
-3.2 |
0.608 |
27 |
2 |
0 |
0.208 |
6 |
|
H |
160 |
46 |
20026 |
◊ |
E |
x,y,z |
1_555 |
165 |
46 |
19779 |
1505.2 |
-4.1 |
0.568 |
28 |
2 |
0 |
0.208 |
7 |
|
C |
161 |
45 |
19791 |
◊ |
B |
x,y,z |
1_555 |
166 |
46 |
19802 |
1490.9 |
-3.2 |
0.631 |
27 |
2 |
0 |
0.208 |
8 |
|
D |
162 |
44 |
19772 |
◊ |
A |
x,y,z |
1_555 |
164 |
46 |
19838 |
1484.4 |
-4.3 |
0.559 |
26 |
2 |
0 |
0.208 |
Average: |
1499.5 |
-3.7 |
0.592 |
27 |
2 |
0 |
0.208 |
3 |
9 |
|
C |
113 |
34 |
19791 |
◊ |
F |
x,y-1,z |
1_545 |
111 |
32 |
19969 |
1097.1 |
-0.9 |
0.678 |
18 |
8 |
0 |
0.000 |
4 |
10 |
|
C |
114 |
29 |
19791 |
◊ |
A |
x,y,z |
1_555 |
115 |
30 |
19838 |
1019.3 |
-5.1 |
0.434 |
6 |
2 |
0 |
0.066 |
11 |
|
H |
115 |
30 |
20026 |
◊ |
F |
x,y,z |
1_555 |
116 |
31 |
19969 |
1013.0 |
-6.7 |
0.331 |
6 |
2 |
0 |
0.066 |
12 |
|
D |
114 |
29 |
19772 |
◊ |
B |
x,y,z |
1_555 |
118 |
30 |
19802 |
1001.6 |
-4.5 |
0.484 |
5 |
2 |
0 |
0.066 |
13 |
|
G |
113 |
30 |
19956 |
◊ |
E |
x,y,z |
1_555 |
111 |
30 |
19779 |
998.0 |
-6.1 |
0.358 |
5 |
2 |
0 |
0.066 |
Average: |
1008.0 |
-5.6 |
0.402 |
6 |
2 |
0 |
0.066 |
5 |
14 |
|
[NAD]H:8502 |
42 |
1 |
813 |
f |
H |
x,y,z |
1_555 |
77 |
28 |
20026 |
578.8 |
-6.7 |
0.418 |
10 |
0 |
0 |
0.289 |
15 |
|
[NAD]F:6502 |
42 |
1 |
812 |
f |
F |
x,y,z |
1_555 |
77 |
29 |
19969 |
577.1 |
-6.5 |
0.405 |
11 |
0 |
0 |
0.289 |
16 |
|
[NAD]E:5502 |
41 |
1 |
814 |
f |
E |
x,y,z |
1_555 |
80 |
30 |
19779 |
576.0 |
-6.3 |
0.468 |
11 |
0 |
0 |
0.289 |
17 |
|
[NAD]D:4502 |
41 |
1 |
809 |
f |
D |
x,y,z |
1_555 |
80 |
30 |
19772 |
574.4 |
-7.1 |
0.397 |
9 |
0 |
0 |
0.289 |
18 |
|
[NAD]A:1502 |
42 |
1 |
802 |
f |
A |
x,y,z |
1_555 |
78 |
30 |
19838 |
572.5 |
-6.5 |
0.406 |
9 |
0 |
0 |
0.289 |
19 |
|
[NAD]G:7502 |
42 |
1 |
805 |
f |
G |
x,y,z |
1_555 |
75 |
29 |
19956 |
568.8 |
-6.5 |
0.424 |
10 |
0 |
0 |
0.289 |
20 |
|
[NAD]C:3502 |
42 |
1 |
806 |
f |
C |
x,y,z |
1_555 |
72 |
28 |
19791 |
567.9 |
-6.5 |
0.402 |
10 |
0 |
0 |
0.289 |
21 |
|
[NAD]B:2502 |
41 |
1 |
812 |
f |
B |
x,y,z |
1_555 |
77 |
29 |
19802 |
566.6 |
-7.7 |
0.337 |
10 |
0 |
0 |
0.289 |
Average: |
572.8 |
-6.7 |
0.407 |
10 |
0 |
0 |
0.289 |
6 |
22 |
|
C |
35 |
15 |
19791 |
◊ |
G |
-x+1,y-1/2,-z+3/2 |
3_646 |
34 |
10 |
19956 |
314.6 |
0.6 |
0.701 |
3 |
1 |
0 |
0.000 |
23 |
|
B |
20 |
8 |
19802 |
◊ |
F |
-x+1,y-1/2,-z+1/2 |
3_645 |
19 |
9 |
19969 |
184.4 |
0.7 |
0.717 |
1 |
1 |
0 |
0.000 |
Average: |
249.5 |
0.6 |
0.709 |
2 |
1 |
0 |
0.000 |
7 |
24 |
|
B |
32 |
9 |
19802 |
◊ |
E |
-x+1,y-1/2,-z+1/2 |
3_645 |
34 |
8 |
19779 |
294.4 |
-2.3 |
0.354 |
1 |
1 |
0 |
0.000 |
25 |
|
D |
31 |
7 |
19772 |
◊ |
G |
-x+1,y-1/2,-z+3/2 |
3_646 |
34 |
10 |
19956 |
280.4 |
-1.4 |
0.450 |
3 |
1 |
0 |
0.000 |
Average: |
287.4 |
-1.9 |
0.402 |
2 |
1 |
0 |
0.000 |
8 |
26 |
|
D |
39 |
10 |
19772 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
38 |
13 |
20026 |
286.1 |
1.2 |
0.751 |
3 |
0 |
0 |
0.000 |
9 |
27 |
|
D |
32 |
11 |
19772 |
◊ |
E |
x,y-1,z |
1_545 |
31 |
11 |
19779 |
268.2 |
2.7 |
0.868 |
5 |
4 |
0 |
0.000 |
10 |
28 |
|
B |
31 |
11 |
19802 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
25 |
11 |
19779 |
261.5 |
-3.2 |
0.193 |
1 |
0 |
0 |
0.000 |
11 |
29 |
|
H |
24 |
11 |
20026 |
◊ |
A |
x,y,z |
1_555 |
25 |
9 |
19838 |
219.7 |
0.8 |
0.709 |
2 |
1 |
0 |
0.000 |
12 |
30 |
|
E |
18 |
4 |
19779 |
◊ |
F |
x-1/2,-y+3/2,-z+1 |
4_466 |
21 |
9 |
19969 |
130.3 |
0.4 |
0.663 |
1 |
1 |
0 |
0.000 |
31 |
|
D |
11 |
3 |
19772 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
10 |
3 |
19791 |
87.5 |
0.3 |
0.604 |
0 |
0 |
0 |
0.000 |
Average: |
108.9 |
0.4 |
0.633 |
1 |
1 |
0 |
0.000 |
13 |
32 |
|
G |
12 |
4 |
19956 |
◊ |
F |
-x+1,y-1/2,-z+3/2 |
3_646 |
17 |
6 |
19969 |
104.5 |
-0.7 |
0.494 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
10 |
4 |
19791 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
3 |
19802 |
39.6 |
-0.2 |
0.562 |
0 |
0 |
0 |
0.000 |
Average: |
72.0 |
-0.5 |
0.528 |
0 |
0 |
0 |
0.000 |
14 |
34 |
|
D |
11 |
6 |
19772 |
◊ |
G |
-x+1/2,-y+1,z-1/2 |
2_564 |
15 |
7 |
19956 |
93.1 |
-0.4 |
0.542 |
0 |
0 |
0 |
0.000 |
15 |
35 |
|
E |
24 |
12 |
19779 |
◊ |
H |
x-1/2,-y+3/2,-z+1 |
4_466 |
14 |
7 |
20026 |
87.1 |
-0.6 |
0.487 |
0 |
0 |
0 |
0.000 |
16 |
36 |
|
B |
11 |
5 |
19802 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
11 |
3 |
19838 |
83.1 |
1.9 |
0.835 |
2 |
0 |
0 |
0.000 |
37 |
|
H |
6 |
3 |
20026 |
◊ |
G |
-x+1,y-1/2,-z+3/2 |
3_646 |
5 |
3 |
19956 |
45.5 |
0.6 |
0.667 |
1 |
0 |
0 |
0.000 |
Average: |
64.3 |
1.2 |
0.751 |
2 |
0 |
0 |
0.000 |
17 |
38 |
|
[NA]H:1608 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
10 |
5 |
20026 |
68.9 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
39 |
|
[NA]C:1603 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
19791 |
68.5 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
40 |
|
[NA]F:1606 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
10 |
5 |
19969 |
68.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.303 |
41 |
|
[NA]B:1602 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
19802 |
67.6 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
42 |
|
[NA]A:1601 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
19838 |
67.3 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
43 |
|
[NA]E:1605 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
9 |
4 |
19779 |
67.2 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
44 |
|
[NA]D:1604 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
19772 |
66.8 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
45 |
|
[NA]G:1607 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
9 |
4 |
19956 |
66.5 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
Average: |
67.6 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.303 |
18 |
46 |
|
E |
6 |
2 |
19779 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
5 |
1 |
19838 |
44.0 |
0.6 |
0.776 |
1 |
0 |
0 |
0.000 |
19 |
47 |
|
[NAD]A:1502 |
6 |
1 |
802 |
f |
[MG]A:1701 |
x,y,z |
1_555 |
1 |
1 |
98 |
42.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.150 |
48 |
|
[NAD]B:2502 |
5 |
1 |
812 |
f |
[MG]B:1702 |
x,y,z |
1_555 |
1 |
1 |
98 |
42.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.150 |
49 |
|
[NAD]H:8502 |
5 |
1 |
813 |
f |
[MG]H:1708 |
x,y,z |
1_555 |
1 |
1 |
98 |
42.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.150 |
50 |
|
[NAD]F:6502 |
5 |
1 |
812 |
f |
[MG]F:1706 |
x,y,z |
1_555 |
1 |
1 |
98 |
41.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.150 |
51 |
|
[NAD]C:3502 |
6 |
1 |
806 |
f |
[MG]C:1703 |
x,y,z |
1_555 |
1 |
1 |
98 |
41.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.150 |
52 |
|
[NAD]E:5502 |
3 |
1 |
814 |
f |
[MG]E:1705 |
x,y,z |
1_555 |
1 |
1 |
98 |
41.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.150 |
53 |
|
[NAD]D:4502 |
5 |
1 |
809 |
f |
[MG]D:1704 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.150 |
54 |
|
[NAD]G:7502 |
5 |
1 |
805 |
f |
[MG]G:1707 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.150 |
Average: |
41.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.150 |
20 |
55 |
|
D |
8 |
5 |
19772 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
5 |
19838 |
41.5 |
0.8 |
0.747 |
0 |
0 |
0 |
0.000 |
21 |
56 |
|
[MG]E:1705 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
5 |
3 |
19779 |
27.2 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.078 |
57 |
|
[MG]D:1704 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
19772 |
27.1 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.078 |
58 |
|
[MG]G:1707 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
6 |
3 |
19956 |
26.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.078 |
59 |
|
[MG]A:1701 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
19838 |
26.1 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.078 |
60 |
|
[MG]F:1706 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
6 |
3 |
19969 |
25.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.078 |
61 |
|
[MG]C:1703 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
19791 |
24.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.078 |
62 |
|
[MG]B:1702 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
19802 |
24.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.078 |
63 |
|
[MG]H:1708 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
4 |
2 |
20026 |
20.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.078 |
Average: |
25.1 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.078 |
22 |
64 |
|
B |
2 |
1 |
19802 |
◊ |
G |
-x+1/2,-y+1,z-1/2 |
2_564 |
5 |
3 |
19956 |
21.2 |
0.3 |
0.725 |
0 |
0 |
0 |
0.000 |
23 |
65 |
|
A |
3 |
1 |
19838 |
◊ |
F |
x-1/2,-y+3/2,-z+1 |
4_466 |
4 |
1 |
19969 |
20.2 |
0.2 |
0.638 |
0 |
0 |
0 |
0.000 |
24 |
66 |
|
A |
1 |
1 |
19838 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
19791 |
12.2 |
0.7 |
0.921 |
0 |
0 |
0 |
0.000 |
25 |
67 |
|
B |
3 |
1 |
19802 |
◊ |
F |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
19969 |
5.8 |
0.2 |
0.723 |
0 |
0 |
0 |
0.000 |
68 |
|
C |
3 |
2 |
19791 |
◊ |
G |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
1 |
19956 |
0.7 |
0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
Average: |
3.3 |
0.1 |
0.673 |
0 |
0 |
0 |
0.000 |
26 |
69 |
|
H |
1 |
1 |
20026 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
19791 |
1.8 |
0.1 |
0.740 |
0 |
0 |
0 |
0.000 |
|