## |
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 |
69 |
17 |
3003 |
◊ |
A |
x,y,z |
1_555 |
63 |
18 |
3022 |
679.6 |
-12.6 |
0.576 |
3 |
3 |
0 |
0.670 |
2 |
|
C |
59 |
16 |
3045 |
◊ |
A |
x,y,z |
1_555 |
67 |
16 |
3022 |
675.2 |
-15.8 |
0.354 |
0 |
0 |
0 |
0.670 |
3 |
|
G |
71 |
16 |
3054 |
◊ |
B |
x,y,z |
1_555 |
62 |
17 |
3003 |
670.8 |
-14.8 |
0.422 |
1 |
2 |
0 |
0.670 |
4 |
|
G |
60 |
17 |
3054 |
◊ |
E |
x,y,z |
1_555 |
65 |
16 |
2997 |
669.1 |
-15.5 |
0.311 |
0 |
0 |
0 |
0.670 |
5 |
|
F |
59 |
16 |
3016 |
◊ |
C |
x,y,z |
1_555 |
69 |
16 |
3045 |
656.7 |
-15.8 |
0.345 |
0 |
0 |
0 |
0.670 |
6 |
|
F |
65 |
16 |
3016 |
◊ |
E |
x,y,z |
1_555 |
63 |
17 |
2997 |
654.7 |
-15.0 |
0.360 |
0 |
0 |
0 |
0.670 |
Average: |
667.7 |
-14.9 |
0.395 |
1 |
1 |
0 |
0.670 |
2 |
7 |
|
C |
20 |
4 |
3045 |
◊ |
G |
x-1/2,-y+1/2,-z-1/2 |
6_454 |
19 |
6 |
3054 |
175.4 |
-1.9 |
0.720 |
1 |
2 |
0 |
0.008 |
8 |
|
F |
18 |
4 |
3016 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
18 |
5 |
3022 |
147.1 |
-1.4 |
0.737 |
1 |
2 |
0 |
0.008 |
Average: |
161.3 |
-1.7 |
0.728 |
1 |
2 |
0 |
0.008 |
3 |
9 |
|
F |
15 |
4 |
3016 |
◊ |
B |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
18 |
4 |
3003 |
149.6 |
-0.3 |
0.809 |
1 |
0 |
0 |
0.000 |
4 |
10 |
|
C |
15 |
4 |
3045 |
◊ |
E |
x-1/2,-y+1/2,-z-1/2 |
6_454 |
19 |
4 |
2997 |
148.9 |
-1.8 |
0.702 |
0 |
0 |
0 |
0.000 |
5 |
11 |
|
B |
14 |
4 |
3003 |
◊ |
B |
-x,-y+1,z |
2_565 |
14 |
4 |
3003 |
128.5 |
-4.0 |
0.382 |
0 |
0 |
0 |
0.000 |
6 |
12 |
|
E |
15 |
4 |
2997 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
11 |
5 |
3022 |
112.9 |
-0.8 |
0.747 |
0 |
0 |
0 |
0.000 |
13 |
|
F |
8 |
4 |
3016 |
◊ |
G |
x-1/2,-y+1/2,-z-1/2 |
6_454 |
11 |
4 |
3054 |
92.4 |
0.5 |
0.818 |
0 |
0 |
0 |
0.000 |
Average: |
102.7 |
-0.2 |
0.782 |
0 |
0 |
0 |
0.000 |
7 |
14 |
|
[GOL]F:35 |
6 |
1 |
220 |
f |
A |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
20 |
4 |
3022 |
99.4 |
-1.4 |
0.602 |
0 |
0 |
0 |
0.016 |
8 |
15 |
|
[GOL]E:35 |
6 |
1 |
216 |
f |
E |
x,y,z |
1_555 |
19 |
5 |
2997 |
91.3 |
-0.9 |
0.662 |
0 |
0 |
0 |
0.007 |
9 |
16 |
|
[ACE]G:0 |
3 |
1 |
171 |
cf |
G |
x,y,z |
1_555 |
7 |
2 |
3054 |
74.1 |
-0.8 |
0.746 |
0 |
0 |
0 |
0.100 |
10 |
17 |
|
[ACE]B:0 |
3 |
1 |
170 |
cf |
B |
x,y,z |
1_555 |
6 |
2 |
3003 |
73.2 |
-0.8 |
0.765 |
0 |
0 |
0 |
0.100 |
18 |
|
[ACE]C:0 |
3 |
1 |
170 |
cf |
C |
x,y,z |
1_555 |
8 |
2 |
3045 |
71.7 |
-0.7 |
0.768 |
0 |
0 |
0 |
0.100 |
19 |
|
[ACE]A:0 |
3 |
1 |
170 |
cf |
A |
x,y,z |
1_555 |
7 |
2 |
3022 |
71.3 |
-0.7 |
0.769 |
0 |
0 |
0 |
0.100 |
Average: |
72.1 |
-0.7 |
0.767 |
0 |
0 |
0 |
0.100 |
11 |
20 |
|
[ACE]F:0 |
3 |
1 |
171 |
cf |
F |
x,y,z |
1_555 |
7 |
2 |
3016 |
70.8 |
-0.9 |
0.752 |
0 |
0 |
0 |
0.009 |
21 |
|
[ACE]E:0 |
3 |
1 |
171 |
cf |
E |
x,y,z |
1_555 |
7 |
2 |
2997 |
68.0 |
-0.4 |
0.837 |
0 |
0 |
0 |
0.009 |
Average: |
69.4 |
-0.6 |
0.794 |
0 |
0 |
0 |
0.009 |
12 |
22 |
|
G |
10 |
3 |
3054 |
◊ |
B |
-x,-y+1,z |
2_565 |
6 |
2 |
3003 |
69.7 |
0.3 |
0.808 |
1 |
0 |
0 |
0.000 |
13 |
23 |
|
[NA]E:187 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
11 |
4 |
2997 |
65.2 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.074 |
14 |
24 |
|
G |
7 |
3 |
3054 |
◊ |
G |
-y,-x,-z |
8_555 |
7 |
3 |
3054 |
63.0 |
-1.4 |
0.540 |
0 |
0 |
0 |
0.027 |
25 |
|
F |
8 |
3 |
3016 |
◊ |
A |
-y,-x,-z |
8_555 |
8 |
3 |
3022 |
62.1 |
-1.4 |
0.591 |
0 |
0 |
0 |
0.027 |
26 |
|
C |
7 |
3 |
3045 |
◊ |
C |
-y,-x,-z |
8_555 |
7 |
3 |
3045 |
60.7 |
-1.4 |
0.561 |
0 |
0 |
0 |
0.027 |
27 |
|
E |
8 |
4 |
2997 |
◊ |
B |
-y,-x,-z |
8_555 |
8 |
3 |
3003 |
58.7 |
-1.2 |
0.609 |
0 |
0 |
0 |
0.027 |
Average: |
61.1 |
-1.3 |
0.575 |
0 |
0 |
0 |
0.027 |
15 |
28 |
|
[GOL]F:35 |
5 |
1 |
220 |
◊ |
F |
x,y,z |
1_555 |
8 |
2 |
3016 |
61.8 |
-0.6 |
0.518 |
0 |
0 |
0 |
0.002 |
16 |
29 |
|
[NA]C:188 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
3045 |
60.6 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.143 |
30 |
|
F |
9 |
4 |
3016 |
f |
[NA]B:186 |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
1 |
1 |
125 |
58.2 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.143 |
Average: |
59.4 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.143 |
17 |
31 |
|
[GOL]E:35 |
4 |
1 |
216 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
7 |
1 |
3022 |
57.2 |
-0.4 |
0.602 |
1 |
0 |
0 |
0.000 |
18 |
32 |
|
[NA]E:185 |
1 |
1 |
125 |
f |
A |
-x-1/2,y-1/2,-z-1/2 |
5_444 |
16 |
4 |
3022 |
55.2 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.076 |
19 |
33 |
|
[ACE]F:0 |
3 |
1 |
171 |
◊ |
[ACE]A:0 |
-y,-x,-z |
8_555 |
3 |
1 |
170 |
40.8 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.012 |
34 |
|
[ACE]E:0 |
3 |
1 |
171 |
◊ |
[ACE]B:0 |
-y,-x,-z |
8_555 |
3 |
1 |
170 |
39.0 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.012 |
Average: |
39.9 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.012 |
20 |
35 |
|
[ACE]G:0 |
3 |
1 |
171 |
◊ |
[ACE]G:0 |
-y,-x,-z |
8_555 |
3 |
1 |
171 |
38.8 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.006 |
36 |
|
[ACE]C:0 |
3 |
1 |
170 |
◊ |
[ACE]C:0 |
-y,-x,-z |
8_555 |
3 |
1 |
170 |
38.7 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.006 |
Average: |
38.8 |
-0.9 |
0.852 |
0 |
0 |
0 |
0.006 |
21 |
37 |
|
[ACE]B:0 |
3 |
1 |
170 |
◊ |
E |
-y,-x,-z |
8_555 |
2 |
1 |
2997 |
34.8 |
-0.2 |
0.777 |
0 |
0 |
0 |
0.002 |
38 |
|
[ACE]C:0 |
3 |
1 |
170 |
◊ |
C |
-y,-x,-z |
8_555 |
2 |
1 |
3045 |
32.3 |
-0.1 |
0.815 |
0 |
0 |
0 |
0.002 |
Average: |
33.6 |
-0.1 |
0.796 |
0 |
0 |
0 |
0.002 |
22 |
39 |
|
[ACE]A:0 |
3 |
1 |
170 |
◊ |
F |
-y,-x,-z |
8_555 |
2 |
1 |
3016 |
34.6 |
-0.2 |
0.801 |
0 |
0 |
0 |
0.001 |
23 |
40 |
|
[ACE]E:0 |
3 |
1 |
171 |
◊ |
B |
-y,-x,-z |
8_555 |
2 |
1 |
3003 |
34.2 |
-0.1 |
0.791 |
0 |
0 |
0 |
0.000 |
41 |
|
[ACE]F:0 |
3 |
1 |
171 |
◊ |
A |
-y,-x,-z |
8_555 |
2 |
1 |
3022 |
33.1 |
-0.0 |
0.810 |
0 |
0 |
0 |
0.000 |
Average: |
33.6 |
-0.1 |
0.800 |
0 |
0 |
0 |
0.001 |
24 |
42 |
|
[NA]E:185 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
2997 |
34.1 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
43 |
|
[ACE]G:0 |
3 |
1 |
171 |
◊ |
G |
-y,-x,-z |
8_555 |
2 |
1 |
3054 |
31.8 |
-0.1 |
0.792 |
0 |
0 |
0 |
0.000 |
26 |
44 |
|
C |
1 |
1 |
3045 |
◊ |
A |
-y,-x,-z |
8_555 |
1 |
1 |
3022 |
31.7 |
-1.0 |
0.158 |
0 |
0 |
0 |
0.020 |
45 |
|
G |
1 |
1 |
3054 |
◊ |
E |
-y,-x,-z |
8_555 |
1 |
1 |
2997 |
30.8 |
-1.0 |
0.167 |
0 |
0 |
0 |
0.020 |
46 |
|
F |
1 |
1 |
3016 |
◊ |
B |
-y,-x,-z |
8_555 |
1 |
1 |
3003 |
30.8 |
-1.0 |
0.164 |
0 |
0 |
0 |
0.020 |
Average: |
31.1 |
-1.0 |
0.163 |
0 |
0 |
0 |
0.020 |
27 |
47 |
|
[CL]A:189 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
2 |
1 |
3054 |
23.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.096 |
48 |
|
[CL]A:189 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
2997 |
22.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.096 |
49 |
|
[CL]A:189 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
3045 |
22.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.096 |
50 |
|
[CL]A:189 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
3016 |
21.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.096 |
51 |
|
[CL]A:189 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
3003 |
20.7 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.096 |
52 |
|
[CL]A:189 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
3022 |
20.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.096 |
Average: |
21.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.096 |
28 |
53 |
|
[NA]E:185 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
5 |
1 |
3016 |
22.4 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.011 |
29 |
54 |
|
[GOL]E:35 |
3 |
1 |
216 |
f |
[NA]E:187 |
x,y,z |
1_555 |
1 |
1 |
125 |
17.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.015 |
30 |
55 |
|
[NA]E:187 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
3 |
2 |
3054 |
16.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.011 |
31 |
56 |
|
[NA]B:186 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
3003 |
16.2 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
57 |
|
[NA]C:188 |
1 |
1 |
125 |
◊ |
E |
x-1/2,-y+1/2,-z-1/2 |
6_454 |
2 |
1 |
2997 |
8.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
12.6 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
58 |
|
[NA]C:188 |
1 |
1 |
125 |
◊ |
G |
x-1/2,-y+1/2,-z-1/2 |
6_454 |
4 |
2 |
3054 |
15.7 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.005 |
59 |
|
[NA]B:186 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
3022 |
13.4 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.005 |
Average: |
14.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.005 |
33 |
60 |
|
[ACE]B:0 |
1 |
1 |
170 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
3022 |
6.8 |
-0.0 |
0.634 |
0 |
0 |
0 |
0.000 |
61 |
|
[ACE]A:0 |
1 |
1 |
170 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
3045 |
4.8 |
-0.0 |
0.568 |
0 |
0 |
0 |
0.000 |
62 |
|
[ACE]C:0 |
1 |
1 |
170 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
3016 |
2.4 |
-0.0 |
0.596 |
0 |
0 |
0 |
0.000 |
Average: |
4.7 |
-0.0 |
0.599 |
0 |
0 |
0 |
0.000 |
34 |
63 |
|
[ACE]G:0 |
1 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
3003 |
4.0 |
-0.0 |
0.656 |
0 |
0 |
0 |
0.000 |
35 |
64 |
|
[ACE]E:0 |
1 |
1 |
171 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
3054 |
3.5 |
-0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
65 |
|
[ACE]F:0 |
1 |
1 |
171 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
2997 |
1.9 |
-0.0 |
0.608 |
0 |
0 |
0 |
0.000 |
Average: |
2.7 |
-0.0 |
0.589 |
0 |
0 |
0 |
0.000 |
36 |
66 |
|
G |
1 |
1 |
3054 |
◊ |
B |
-y,-x,-z |
8_555 |
1 |
1 |
3003 |
1.3 |
-0.0 |
0.599 |
0 |
0 |
0 |
0.000 |
67 |
|
F |
2 |
2 |
3016 |
◊ |
C |
-y,-x,-z |
8_555 |
2 |
2 |
3045 |
0.9 |
-0.0 |
0.715 |
0 |
0 |
0 |
0.000 |
68 |
|
E |
1 |
1 |
2997 |
◊ |
A |
-y,-x,-z |
8_555 |
1 |
1 |
3022 |
0.3 |
-0.0 |
0.654 |
0 |
0 |
0 |
0.000 |
Average: |
0.8 |
-0.0 |
0.656 |
0 |
0 |
0 |
0.001 |
|