## |
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 |
207 |
51 |
13644 |
◊ |
F |
x,y,z |
1_555 |
216 |
54 |
13359 |
1972.1 |
-13.3 |
0.213 |
28 |
18 |
0 |
1.000 |
2 |
|
D |
207 |
53 |
13618 |
◊ |
B |
x,y,z |
1_555 |
211 |
54 |
13315 |
1959.5 |
-14.0 |
0.177 |
28 |
18 |
0 |
1.000 |
Average: |
1965.8 |
-13.6 |
0.195 |
28 |
18 |
0 |
1.000 |
2 |
3 |
|
C |
198 |
53 |
17940 |
◊ |
A |
x,y,z |
1_555 |
208 |
55 |
18203 |
1872.7 |
-22.2 |
0.067 |
30 |
0 |
0 |
0.536 |
4 |
|
G |
188 |
51 |
17846 |
◊ |
E |
x,y,z |
1_555 |
197 |
52 |
17644 |
1831.3 |
-21.7 |
0.074 |
27 |
0 |
0 |
0.536 |
Average: |
1852.0 |
-22.0 |
0.070 |
29 |
0 |
0 |
0.536 |
3 |
5 |
|
H |
173 |
49 |
13644 |
◊ |
G |
x,y,z |
1_555 |
182 |
47 |
17846 |
1685.3 |
-20.8 |
0.024 |
20 |
4 |
0 |
0.694 |
6 |
|
D |
176 |
49 |
13618 |
◊ |
C |
x,y,z |
1_555 |
171 |
47 |
17940 |
1666.9 |
-21.6 |
0.016 |
22 |
4 |
0 |
0.694 |
7 |
|
B |
173 |
52 |
13315 |
◊ |
A |
x,y,z |
1_555 |
174 |
45 |
18203 |
1657.2 |
-21.1 |
0.028 |
23 |
4 |
0 |
0.694 |
8 |
|
F |
177 |
52 |
13359 |
◊ |
E |
x,y,z |
1_555 |
182 |
47 |
17644 |
1642.5 |
-21.0 |
0.039 |
21 |
4 |
0 |
0.694 |
Average: |
1663.0 |
-21.1 |
0.027 |
22 |
4 |
0 |
0.694 |
4 |
9 |
|
D |
146 |
43 |
13618 |
◊ |
A |
x,y,z |
1_555 |
148 |
47 |
18203 |
1350.0 |
-8.4 |
0.232 |
17 |
3 |
0 |
0.638 |
10 |
|
B |
146 |
45 |
13315 |
◊ |
C |
x,y,z |
1_555 |
151 |
45 |
17940 |
1296.9 |
-10.6 |
0.170 |
21 |
3 |
0 |
0.638 |
11 |
|
F |
142 |
40 |
13359 |
◊ |
G |
x,y,z |
1_555 |
143 |
44 |
17846 |
1276.8 |
-12.4 |
0.113 |
16 |
0 |
0 |
0.638 |
12 |
|
H |
136 |
39 |
13644 |
◊ |
E |
x,y,z |
1_555 |
135 |
43 |
17644 |
1177.4 |
-11.7 |
0.110 |
15 |
2 |
0 |
0.638 |
Average: |
1275.3 |
-10.8 |
0.156 |
17 |
2 |
0 |
0.638 |
5 |
13 |
|
A |
114 |
37 |
18203 |
◊ |
C |
x-1,y,z |
1_455 |
107 |
37 |
17940 |
907.1 |
2.9 |
0.868 |
6 |
2 |
0 |
0.000 |
6 |
14 |
|
H |
81 |
22 |
13644 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
87 |
23 |
13618 |
743.9 |
-1.3 |
0.612 |
8 |
3 |
0 |
0.000 |
7 |
15 |
|
G |
58 |
20 |
17846 |
◊ |
B |
x,y,z-1 |
1_554 |
52 |
19 |
13315 |
465.1 |
2.4 |
0.849 |
6 |
5 |
0 |
0.000 |
8 |
16 |
|
H |
44 |
14 |
13644 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
45 |
14 |
13618 |
411.4 |
5.7 |
0.949 |
5 |
2 |
0 |
0.000 |
9 |
17 |
|
I |
43 |
11 |
3204 |
◊ |
D |
x,y,z |
1_555 |
46 |
11 |
13618 |
383.4 |
-1.7 |
0.500 |
5 |
3 |
0 |
0.140 |
18 |
|
J |
41 |
9 |
3038 |
◊ |
H |
x,y,z |
1_555 |
41 |
9 |
13644 |
346.1 |
-2.7 |
0.376 |
5 |
3 |
0 |
0.140 |
Average: |
364.8 |
-2.2 |
0.438 |
5 |
3 |
0 |
0.140 |
10 |
19 |
|
[TPW]G:1370 |
24 |
1 |
591 |
f |
G |
x,y,z |
1_555 |
52 |
18 |
17846 |
306.0 |
1.5 |
0.566 |
10 |
0 |
0 |
0.175 |
20 |
|
[TPW]C:1370 |
24 |
1 |
588 |
f |
C |
x,y,z |
1_555 |
49 |
19 |
17940 |
305.0 |
-0.6 |
0.552 |
9 |
0 |
0 |
0.175 |
21 |
|
[TPW]E:1370 |
24 |
1 |
585 |
f |
E |
x,y,z |
1_555 |
50 |
19 |
17644 |
303.2 |
-0.8 |
0.535 |
11 |
0 |
0 |
0.175 |
22 |
|
[TPW]A:1370 |
24 |
1 |
587 |
f |
A |
x,y,z |
1_555 |
50 |
19 |
18203 |
298.7 |
-1.1 |
0.543 |
10 |
0 |
0 |
0.175 |
Average: |
303.2 |
-0.2 |
0.549 |
10 |
0 |
0 |
0.175 |
11 |
23 |
|
I |
28 |
7 |
3204 |
◊ |
B |
x,y,z |
1_555 |
38 |
10 |
13315 |
281.5 |
-2.7 |
0.369 |
3 |
0 |
0 |
0.115 |
24 |
|
J |
22 |
6 |
3038 |
◊ |
F |
x,y,z |
1_555 |
32 |
10 |
13359 |
246.1 |
-3.5 |
0.207 |
2 |
0 |
0 |
0.115 |
Average: |
263.8 |
-3.1 |
0.288 |
3 |
0 |
0 |
0.115 |
12 |
25 |
|
J |
30 |
8 |
3038 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
38 |
9 |
13618 |
276.0 |
0.2 |
0.654 |
0 |
0 |
0 |
0.000 |
26 |
|
H |
33 |
9 |
13644 |
◊ |
I |
-x,y-1/2,-z+1 |
2_546 |
30 |
9 |
3204 |
262.2 |
-0.0 |
0.645 |
1 |
1 |
0 |
0.000 |
Average: |
269.1 |
0.1 |
0.649 |
1 |
1 |
0 |
0.000 |
13 |
27 |
|
G |
28 |
9 |
17846 |
◊ |
C |
x-1,y,z-1 |
1_454 |
34 |
10 |
17940 |
241.1 |
1.3 |
0.778 |
3 |
1 |
0 |
0.000 |
14 |
28 |
|
H |
27 |
8 |
13644 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
29 |
9 |
18203 |
210.5 |
1.8 |
0.795 |
1 |
0 |
0 |
0.000 |
29 |
|
E |
3 |
2 |
17644 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
2 |
2 |
13618 |
17.4 |
0.6 |
0.771 |
0 |
0 |
0 |
0.000 |
Average: |
114.0 |
1.2 |
0.783 |
1 |
0 |
0 |
0.000 |
15 |
30 |
|
[TPW]G:1370 |
17 |
1 |
591 |
◊ |
F |
x,y,z |
1_555 |
25 |
9 |
13359 |
177.2 |
2.3 |
0.532 |
0 |
0 |
0 |
0.000 |
31 |
|
[TPW]A:1370 |
18 |
1 |
587 |
◊ |
D |
x,y,z |
1_555 |
26 |
9 |
13618 |
176.8 |
2.1 |
0.505 |
0 |
0 |
0 |
0.000 |
32 |
|
[TPW]E:1370 |
18 |
1 |
585 |
◊ |
H |
x,y,z |
1_555 |
27 |
9 |
13644 |
176.5 |
2.0 |
0.508 |
0 |
0 |
0 |
0.000 |
33 |
|
[TPW]C:1370 |
17 |
1 |
588 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
13315 |
173.0 |
2.2 |
0.509 |
0 |
0 |
0 |
0.000 |
Average: |
175.9 |
2.1 |
0.514 |
0 |
0 |
0 |
0.000 |
16 |
34 |
|
F |
25 |
9 |
13359 |
◊ |
C |
x,y,z |
1_555 |
24 |
9 |
17940 |
165.6 |
0.9 |
0.719 |
1 |
0 |
0 |
0.000 |
17 |
35 |
|
E |
18 |
3 |
17644 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
22 |
5 |
18203 |
145.8 |
-0.3 |
0.625 |
0 |
0 |
0 |
0.000 |
18 |
36 |
|
G |
16 |
5 |
17846 |
◊ |
C |
x-1,y,z |
1_455 |
18 |
6 |
17940 |
117.3 |
0.9 |
0.732 |
0 |
0 |
0 |
0.000 |
19 |
37 |
|
[K]B:1325 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
13315 |
110.0 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.881 |
38 |
|
[K]D:1325 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
13618 |
108.9 |
-108.0 |
0.000 |
0 |
0 |
0 |
0.881 |
Average: |
109.5 |
-108.1 |
0.000 |
0 |
0 |
0 |
0.881 |
20 |
39 |
|
G |
12 |
5 |
17846 |
◊ |
E |
x-1,y,z |
1_455 |
15 |
6 |
17644 |
102.2 |
0.9 |
0.735 |
0 |
1 |
0 |
0.000 |
21 |
40 |
|
F |
8 |
3 |
13359 |
◊ |
C |
x-1,y,z |
1_455 |
7 |
2 |
17940 |
82.8 |
1.1 |
0.827 |
1 |
3 |
0 |
0.000 |
22 |
41 |
|
G |
10 |
7 |
17846 |
◊ |
B |
x-1,y,z-1 |
1_454 |
11 |
6 |
13315 |
72.7 |
0.4 |
0.688 |
0 |
0 |
0 |
0.000 |
23 |
42 |
|
A |
8 |
5 |
18203 |
◊ |
I |
x,y,z-1 |
1_554 |
8 |
4 |
3204 |
72.5 |
1.0 |
0.791 |
2 |
2 |
0 |
0.000 |
43 |
|
E |
4 |
2 |
17644 |
◊ |
J |
x,y,z-1 |
1_554 |
2 |
2 |
3038 |
24.4 |
-0.0 |
0.417 |
0 |
0 |
0 |
0.000 |
Average: |
48.4 |
0.5 |
0.604 |
1 |
1 |
0 |
0.000 |
24 |
44 |
|
[MG]E:369 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
8 |
17644 |
40.7 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.203 |
45 |
|
[MG]G:369 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
12 |
8 |
17846 |
39.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.203 |
46 |
|
[MG]A:1368 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
18203 |
38.7 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.203 |
47 |
|
[MG]C:1368 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
17940 |
38.0 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.203 |
Average: |
39.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.203 |
25 |
48 |
|
[TPW]E:1370 |
6 |
1 |
585 |
f |
[MG]E:369 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.1 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.138 |
49 |
|
[TPW]G:1370 |
4 |
1 |
591 |
f |
[MG]G:369 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.6 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.138 |
50 |
|
[TPW]C:1370 |
3 |
1 |
588 |
f |
[MG]C:1368 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.138 |
51 |
|
[TPW]A:1370 |
4 |
1 |
587 |
f |
[MG]A:1368 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.138 |
Average: |
30.6 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.138 |
26 |
52 |
|
H |
2 |
1 |
13644 |
◊ |
E |
x-1,y,z |
1_455 |
4 |
2 |
17644 |
29.0 |
1.0 |
0.898 |
1 |
1 |
0 |
0.000 |
27 |
53 |
|
[MG]E:370 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
7 |
3 |
17644 |
28.1 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.084 |
54 |
|
[MG]A:1326 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
18203 |
28.0 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.084 |
55 |
|
[MG]A:1326 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
17940 |
27.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.084 |
56 |
|
[MG]E:370 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
7 |
3 |
17846 |
25.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.084 |
Average: |
27.3 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.084 |
28 |
57 |
|
[MG]E:370 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
6 |
2 |
13359 |
22.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.021 |
58 |
|
[MG]A:1326 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
13618 |
18.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.021 |
59 |
|
[MG]A:1326 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
13315 |
17.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.021 |
60 |
|
[MG]E:370 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
13644 |
15.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.021 |
Average: |
18.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.021 |
29 |
61 |
|
B |
2 |
1 |
13315 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
2 |
17940 |
20.1 |
0.4 |
0.796 |
0 |
0 |
0 |
0.000 |
62 |
|
A |
2 |
2 |
18203 |
◊ |
D |
x-1,y,z |
1_455 |
4 |
3 |
13618 |
5.6 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
Average: |
12.9 |
0.2 |
0.727 |
0 |
0 |
0 |
0.000 |
30 |
63 |
|
A |
1 |
1 |
18203 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
18203 |
10.1 |
-0.3 |
0.223 |
0 |
0 |
0 |
0.000 |
|