3HP3

crystal structure of cxcl12

• Total interactions analyzed: 45
• Total true interactions: 19
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 70
  • Norm. En. per Res.: -6.323
• Hub Node: A(4)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	-126.3434	38.567	-354.834	-442.6103	70	25	4	12855	0	2	9
A-C	-38.9983	-11.6293	-170.274	-220.9016	68	9	9	7426	0	7	6
A-E	0.0	0.0	-0.6133	-0.6133	5	0	0	129	0	1	6
A-H	0.0	0.0	-0.0012	-0.0012	4	0	0	4	0	0	3
B-C	0.0	0.0	-0.7626	-0.7626	7	0	0	87	0	2	6
B-E	-4.3642	0.0	-92.1012	-96.4654	55	6	7	5207	0	9	7
B-I	0.0	17.2479	-3.3316	13.9163	11	0	0	266	0	9	10
C-D	0.0	0.0	-0.0544	-0.0544	3	0	0	19	0	2	6
C-E	0.0	0.0	-1.0318	-1.0318	8	0	0	129	0	7	5
C-H	-89.6864	47.4078	-332.037	-374.3156	67	18	4	11371	0	2	8
D-F	-94.5623	47.3052	-344.198	-391.4551	70	16	4	12324	0	2	7
D-H	-3.7464	-7.6523	-206.426	-217.8247	65	4	9	9398	0	8	5
D-J	0.0	0.0	-4.9566	-4.9566	10	0	0	249	0	5	7
E-G	-114.6259	42.2235	-341.671	-414.0734	71	21	4	11894	0	2	8
E-I	0.0	0.0	-3.0365	-3.0365	13	0	0	183	0	2	6
F-H	0.0	0.0	-2.3459	-2.3459	4	0	0	134	0	0	5
F-J	-7.7153	0.0	-128.432	-136.1473	61	8	11	7114	0	5	3
G-I	-38.2856	0.0	-196.633	-234.9186	72	8	13	9662	0	9	6
H-J	0.0	6.3774	-4.9314	1.446	11	0	0	238	0	9	6

Interface residues

• A-B: ALA40A, ALA40B, ARG12A, ARG12B, ARG41A, ARG41B, ARG47A, ARG47B, ARG8A, ARG8B, ASN30A, ASN30B, ASN33A, ASN33B, ASN45A, ASN46A, ASN46B, CYS11A, CYS11B, CYS34A, CYS34B, CYS50A, CYS50B, CYS9A, CYS9B, GLN37A, GLN37B, GLN48A, GLN48B, GLU15A, GLU15B, HIS25A, HIS25B, ILE28A, ILE28B, ILE38A, ILE38B, ILE51A, ILE51B, LEU26A, LEU26B, LEU29A, LEU29B, LEU42A, LEU42B, LEU5A, LEU5B, LYS27A, LYS27B, PHE13A, PHE13B, PHE14A, PHE14B, PRO10A, PRO10B, PRO32A, PRO32B, SER4A, SER4B, SER6A, SER6B, THR31A, THR31B, TYR7A, TYR7B, VAL18A, VAL39A, VAL39B, VAL49A, VAL49B
• A-C: ALA35A, ALA35C, ALA40C, ALA65A, ALA65C, ARG20C, ARG41C, ASN30A, ASN30C, ASN33A, ASN33C, ASN67A, ASN67C, ASP52A, ASP52C, CYS34A, CYS34C, GLN37A, GLN37C, GLN59A, GLN59C, GLU60A, GLU60C, GLU63A, GLU63C, HIS25A, HIS25C, ILE28A, ILE28C, ILE38A, ILE38C, ILE58A, ILE58C, LEU26A, LEU26C, LEU29A, LEU29C, LEU36A, LEU36C, LEU55A, LEU55C, LEU62A, LEU62C, LEU66A, LEU66C, LYS24C, LYS27A, LYS27C, LYS54A, LYS54C, LYS56A, LYS56C, LYS64A, LYS64C, PHE14A, PRO32A, PRO32C, PRO53A, PRO53C, THR31A, THR31C, TRP57A, TRP57C, TYR61A, TYR61C, TYR7C, VAL23C, VAL39C
• A-E: GLN59E, HIS25A, LYS27A, LYS54E, LYS56E
• A-H: ARG41H, ASN67A, LYS54A, PRO32H
• B-C: ASN30B, GLN59C, GLU60C, GLU63C, LYS27B, LYS54C, LYS56C
• B-E: ALA35B, ALA35E, ALA65B, ASN30B, ASN30E, ASN33B, ASN33E, ASP52B, ASP52E, CYS34B, CYS34E, GLN37B, GLN37E, GLN59B, GLN59E, GLU60B, GLU60E, GLU63B, GLU63E, HIS25E, ILE28B, ILE28E, ILE38B, ILE38E, ILE58B, ILE58E, LEU26E, LEU29B, LEU29E, LEU36B, LEU36E, LEU55B, LEU55E, LEU62B, LEU62E, LYS27B, LYS27E, LYS54B, LYS54E, LYS56B, LYS64B, LYS64E, PHE14B, PHE14E, PRO10B, PRO32B, PRO32E, PRO53B, PRO53E, THR31B, THR31E, TRP57E, TYR61B, TYR61E, TYR7B
• B-I: GLN59B, GLN59I, GLU60B, GLU60I, GLU63B, GLU63I, LEU55B, LYS54B, LYS56B, LYS56I, LYS64I
• C-D: GLU60D, LYS27C, LYS56D
• C-E: ASN67C, GLN59E, GLU60C, GLU60E, GLU63C, GLU63E, LEU66C, LYS56E
• C-H: ALA40C, ALA40H, ARG12C, ARG12H, ARG41C, ARG41H, ARG47C, ARG47H, ARG8C, ARG8H, ASN30C, ASN30H, ASN33C, ASN33H, ASN45H, ASN46C, ASN46H, CYS11C, CYS11H, CYS34C, CYS34H, CYS50C, CYS50H, CYS9C, CYS9H, GLN37C, GLN37H, GLN48C, GLN48H, GLU15C, GLU15H, HIS25C, HIS25H, ILE28C, ILE38C, ILE38H, ILE51C, ILE51H, LEU26C, LEU29C, LEU29H, LEU42H, LEU5C, LEU5H, LYS27C, LYS27H, PHE13C, PHE13H, PHE14C, PHE14H, PRO10C, PRO10H, PRO32C, PRO32H, SER4C, SER4H, SER6C, SER6H, THR31C, THR31H, TYR7C, TYR7H, VAL18H, VAL39C, VAL39H, VAL49C, VAL49H
• D-F: ALA40D, ALA40F, ARG12D, ARG12F, ARG41D, ARG41F, ARG47D, ARG47F, ARG8D, ARG8F, ASN30D, ASN30F, ASN33D, ASN33F, ASN45D, ASN45F, ASN46D, ASN46F, CYS11D, CYS11F, CYS34D, CYS34F, CYS50D, CYS50F, CYS9D, CYS9F, GLN37D, GLN37F, GLN48D, GLN48F, GLU15D, GLU15F, HIS25D, HIS25F, ILE28D, ILE38D, ILE38F, ILE51D, ILE51F, LEU29D, LEU29F, LEU42F, LEU5D, LEU5F, LYS27D, LYS27F, PHE13D, PHE13F, PHE14D, PHE14F, PRO10D, PRO10F, PRO32D, PRO32F, SER16D, SER4D, SER4F, SER6D, SER6F, THR31D, THR31F, TYR7D, TYR7F, VAL18D, VAL18F, VAL39D, VAL39F, VAL3F, VAL49D, VAL49F
• D-H: ALA35D, ALA35H, ALA65D, ALA65H, ARG20H, ASN30D, ASN30H, ASN33D, ASN33H, ASN67D, ASN67H, ASP52D, ASP52H, CYS34D, CYS34H, CYS9H, GLN37D, GLN37H, GLN59D, GLN59H, GLU60D, GLU60H, GLU63D, GLU63H, HIS25D, HIS25H, ILE28D, ILE28H, ILE38D, ILE38H, ILE51D, ILE58D, ILE58H, LEU26D, LEU26H, LEU29D, LEU29H, LEU36D, LEU36H, LEU55D, LEU55H, LEU62D, LEU62H, LEU66D, LEU66H, LYS27D, LYS27H, LYS54D, LYS54H, LYS56D, LYS56H, LYS64D, LYS64H, PRO32D, PRO32H, PRO53D, PRO53H, THR31D, THR31H, TRP57D, TRP57H, TYR61D, TYR61H, VAL39D, VAL39H
• D-J: ARG41D, GLN59J, GLU60J, HIS25D, ILE28D, LEU55J, LYS27D, LYS54J, LYS56J, PRO53J
• E-G: ALA40E, ALA40G, ARG12E, ARG12G, ARG41E, ARG41G, ARG47E, ARG47G, ARG8E, ARG8G, ASN30E, ASN30G, ASN33E, ASN33G, ASN45E, ASN46E, ASN46G, CYS11E, CYS11G, CYS34E, CYS34G, CYS50E, CYS50G, CYS9E, CYS9G, GLN37E, GLN37G, GLN48E, GLN48G, GLU15E, GLU15G, HIS25E, HIS25G, ILE28E, ILE28G, ILE38E, ILE38G, ILE51E, ILE51G, LEU26E, LEU26G, LEU29E, LEU29G, LEU42E, LEU5E, LEU5G, LYS27E, LYS27G, PHE13E, PHE13G, PHE14E, PHE14G, PRO10E, PRO10G, PRO32E, PRO32G, SER16E, SER4E, SER4G, SER6E, SER6G, THR31E, THR31G, TYR7E, TYR7G, VAL18E, VAL39E, VAL39G, VAL3G, VAL49E, VAL49G
• E-I: ASN30E, ASN67I, GLN48E, GLN59I, GLU60I, GLU63I, HIS25E, LEU29E, LYS27E, LYS54I, LYS56I, PRO32E, THR31E
• F-H: GLN59H, LEU29F, LYS27F, LYS56H
• F-J: ALA35F, ALA35J, ALA65F, ALA65J, ASN30F, ASN30J, ASN33F, ASN33J, ASN67F, ASP52F, ASP52J, CYS34F, CYS34J, GLN37F, GLN37J, GLN59F, GLN59J, GLU60F, GLU60J, GLU63F, GLU63J, HIS25F, HIS25J, ILE28F, ILE28J, ILE38F, ILE38J, ILE51F, ILE51J, ILE58F, ILE58J, LEU26F, LEU26J, LEU29F, LEU29J, LEU36F, LEU36J, LEU55F, LEU55J, LEU62F, LEU62J, LEU66F, LEU66J, LYS27F, LYS27J, LYS54F, LYS54J, LYS56F, LYS56J, LYS64F, LYS64J, PHE14F, PHE14J, PRO32F, PRO32J, PRO53F, PRO53J, THR31F, THR31J, TYR61F, TYR61J
• G-I: ALA35G, ALA35I, ALA40I, ALA65G, ALA65I, ARG41I, ASN30G, ASN30I, ASN33G, ASN33I, ASN67G, ASN67I, ASP52G, ASP52I, CYS34G, CYS34I, GLN37G, GLN37I, GLN59G, GLN59I, GLU60G, GLU60I, GLU63G, GLU63I, HIS25G, HIS25I, ILE28G, ILE28I, ILE38G, ILE38I, ILE51G, ILE51I, ILE58G, ILE58I, LEU26G, LEU26I, LEU29G, LEU29I, LEU36G, LEU36I, LEU55G, LEU55I, LEU62G, LEU62I, LEU66G, LEU66I, LYS24G, LYS24I, LYS27G, LYS27I, LYS54G, LYS54I, LYS56G, LYS56I, LYS64G, LYS64I, PHE14G, PHE14I, PRO32G, PRO32I, PRO53G, PRO53I, THR31G, THR31I, TRP57G, TRP57I, TYR61G, TYR61I, TYR7G, VAL23I, VAL39G, VAL39I
• H-J: ASN67H, GLN59H, GLN59J, GLU60H, GLU60J, GLU63H, GLU63J, LEU66H, LYS56H, LYS56J, LYS64H