2KI6

the fgf1-s100a13-c2a hetero-hexameric complex structure: a component in the non-classical pathway for fgf1 secretion

• Total interactions analyzed: 15
• Total true interactions: 10
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 36
  • Norm. En. per Res.: -3.8598
• Hub Node: A(3)

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	-12.4657	-45.2912	-68.6202	-126.3771	61	8	0	3738	3	29	26
A-C	-6.6739	-0.9039	-51.072	-58.6498	41	2	0	2644	0	9	7
A-D	0.0	7.0013	-9.552	-2.5507	12	0	0	488	0	6	6
B-C	-9.5218	-19.3608	-110.07	-138.9526	36	13	0	3781	2	17	15
C-D	0.0	-10.825	-122.29	-133.115	86	6	9	7287	0	36	29
C-E	0.0	0.0	-0.0445	-0.0445	3	0	0	5	0	2	0
C-F	-10.277	-11.7974	-29.6091	-51.6836	23	2	0	1301	2	7	9
D-E	-10.5872	-12.2645	-92.9667	-115.8184	36	11	1	3748	1	19	12
D-F	-14.8421	4.85	-89.1283	-99.1205	46	3	0	3807	0	19	14
E-F	-3.859	-84.6251	-74.4039	-162.8881	60	6	0	3829	5	28	23

Interface residues

• A-B: ALA126A, ARG112B, ARG115B, ARG121A, ARG17B, ARG28B, ARG30B, ASN107B, ASN109A, ASP112A, ASP122A, ASP21B, ASP25B, ASP29B, ASP32B, CB7.76827-18.86667, CB9.41170-34.19806, CB9.56028-112.79000, CYS110B, GLN120B, GLN124A, GLU103A, GLU127A, GLU1A, GLU1A5, GLY108B, GLY13B, GLY22B, GLY26B, GLY81A, GLY82A, HIS14B, LEU123A, LEU19B, LEU47A, LEU65B, LEU66B, LYS105A, LYS105B, LYS106B, LYS111B, LYS128A, LYS2A, LYS83A, MET108A, PHE104A, PHE15B, PRO107A, PRO114B, PRO48A, SER109B, SER125A, SER31B, THR110A, THR23B, THR27B, THR84A, VAL106A, VAL111A, VAL24B, VAL86A
• A-C: ALA31A, ARG25C, ASP33A, ASP52C, ASP99A, GLN44C, GLN45C, GLU127A, GLU1A, GLU28A, GLU40C, GLY35A, GLY36A, GLY54C, HIS48C, ILE101A, LEU29A, LEU32A, LEU3A, LEU41C, LEU46C, LEU49C, LEU50C, LEU63A, LYS2A, LYS51C, LYS59C, LYS90C, MET34A, PHE23C, PRO30A, PRO47C, SER125A, SER38A, SER55C, THR19C, THR22C, THR37A, THR43C, VAL42C, VAL53C
• A-D: ALA27A, ASN64A, GLU10D, GLU11D, GLU28A, GLU8D, GLY4A, LEU6D, LEU9D, LYS2A, PRO5D, THR7D
• B-C: ALA122B, ALA24C, ARG112B, ARG115B, ARG25C, ARG29C, ASN36C, ASN99B, ASP31C, GLN120B, GLN26C, GLN44C, GLU27C, GLU37C, GLU40C, GLY103B, GLY113B, GLY119B, GLY28C, HIS117B, ILE123B, LEU41C, LYS121B, LYS30C, LYS98B, PHE101B, PHE20C, PHE21C, PHE23C, PRO114B, THR116B, THR18C, THR19C, THR22C, TRP100B, TYR118B
• C-D: ALA3D, ALA84C, ALA84D, ARG78C, ARG78D, ARG88C, ARG88D, ASN74C, ASN74D, ASP31C, ASP31D, GLN44D, GLN45C, GLN45D, GLU10C, GLU10D, GLU11C, GLU11D, GLU14C, GLU14D, GLU75C, GLU75D, GLU82C, GLU82D, GLU86C, GLU86D, GLU8C, GLU8D, GLY81C, GLY81D, HIS48C, HIS48D, ILE13C, ILE13D, ILE80C, ILE80D, ILE87C, ILE87D, LEU41C, LEU41D, LEU46C, LEU46D, LEU49C, LEU49D, LEU50D, LEU6C, LEU6D, LEU79C, LEU79D, LEU83C, LEU83D, LEU9C, LEU9D, LYS72C, LYS72D, LYS85C, LYS85D, LYS89C, LYS89D, LYS90C, PHE20C, PHE20D, PHE23C, PHE23D, PHE73C, PHE73D, PRO47C, PRO47D, SER12C, SER12D, THR15C, THR15D, THR18C, THR18D, THR19C, THR19D, THR7C, THR7D, TRP77C, TRP77D, TYR76D, VAL16C, VAL16D, VAL17C, VAL17D, VAL42D
• C-E: GLN120E, GLU8C, GLY119E
• C-F: ALA27F, ALA2C, ALA3C, ARG121F, ASP122F, GLN7F, GLU10C, GLU118F, GLU119F, GLU1F, GLU28F, GLU4C, GLU8C, GLY4F, LEU123F, LEU6C, LEU9C, LYS2F, LYS5F, MET1C, PRO5C, THR7C, TRP120F
• D-E: ALA24D, ARG112E, ARG115E, ARG25D, ASN36D, ASN99E, ASP63E, GLN120E, GLN26D, GLN44D, GLN45D, GLU14D, GLU27D, GLU37D, GLU40D, GLY113E, GLY119E, HIS117E, ILE123E, LEU41D, LYS30D, LYS39D, LYS98E, PHE101E, PHE21D, PHE23D, PRO114E, THR116E, THR15D, THR18D, THR19D, THR22D, THR43D, TRP100E, TYR118E, VAL42D
• D-F: ALA126F, ALA27F, ALA31F, ASN64F, ASP33F, ASP52D, ASP99F, GLN44D, GLN45D, GLU127F, GLU1F, GLU28F, GLU40D, GLU58D, GLY35F, GLY36F, GLY4F, GLY54D, HIS48D, ILE101F, LEU29F, LEU32F, LEU3F, LEU41D, LEU46D, LEU49D, LEU50D, LEU56D, LEU63F, LYS2F, LYS51D, LYS59D, LYS91D, MET34F, PHE23D, PRO30F, PRO47D, SER125F, SER38F, SER55D, SER96F, THR19D, THR37F, THR43D, VAL42D, VAL53D
• E-F: ALA126F, ARG112E, ARG115E, ARG121F, ARG17E, ARG28E, ARG30E, ASN107E, ASN109F, ASP112F, ASP122F, ASP21E, ASP25E, ASP29E, ASP32E, ASP49F, CYS110E, GLN120E, GLN124F, GLU103F, GLU127F, GLU1F, GLY108E, GLY13E, GLY22E, GLY26E, GLY64E, GLY81F, GLY82F, HIS14E, LEU123F, LEU19E, LEU47F, LEU65E, LEU66E, LYS105E, LYS105F, LYS106E, LYS111E, LYS128F, LYS2F, LYS83F, MET108F, PHE104F, PHE15E, PRO107F, PRO114E, PRO20E, PRO48F, SER109E, SER125F, SER31E, THR110F, THR23E, THR27E, THR84F, VAL106F, VAL111F, VAL24E, VAL86F