Small Angle Scattering Biological Data Bank SASBDB

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SASDN48 – DNA-binding protein from starved cells (tailless): DgrDps∆N in 50 mM MOPS, 50 mM NaCl pH 7.0

DNA protection during starvation, DPS-∆N (Ferritin superfamily) experimental SAS data

Sample:	DNA protection during starvation, DPS-∆N (Ferritin superfamily) dodecamer, 218 kDa Deinococcus grandis protein
Buffer:	50 mM MOPS-NaOH, 50 mM NaCl, pH: 7
Experiment:	SAXS data collected at EMBL P12, PETRA III on 2020 Oct 22

The Conformation of the N-Terminal Tails of Deinococcus grandis Dps Is Modulated by the Ionic Strength International Journal of Molecular Sciences 23(9):4871 (2022)
Guerra J, Blanchet C, Vieira B, Almeida A, Waerenborgh J, Jones N, Hoffmann S, Tavares P, Pereira A

R_g^Guinier	3.8	nm
D_max	9.3	nm
Volume^Porod	290	nm³

SASDN58 – DNA-binding protein from starved cells (tailless): DgrDps∆N in 50 mM MOPS, 230 mM NaCl pH 7.0

Sample:	DNA protection during starvation, DPS-∆N (Ferritin superfamily) dodecamer, 218 kDa Deinococcus grandis protein
Buffer:	50 mM MOPS-NaOH, 230 mM NaCl, pH: 7
Experiment:	SAXS data collected at EMBL P12, PETRA III on 2020 Oct 22

R_g^Guinier	3.8	nm
D_max	8.8	nm
Volume^Porod	291	nm³

SASDNF6 – full-length MERS CoV N -protein complexed with 5-propoxy-1H-indole (P4-1 compound)

Nucleoprotein5-(Propoxy)-1H-indole experimental SAS data

Sample:	Nucleoprotein dodecamer, 548 kDa Middle East respiratory … protein 5-(Propoxy)-1H-indole dodecamer, 2 kDa
Buffer:	50 mM Tris-HCl, 150 mM NaCl, pH: 8.5
Experiment:	SAXS data collected at 23A, Taiwan Photon Source, NSRRC on 2019 Nov 22

Targeting the N-Terminus Domain of the Coronavirus Nucleocapsid Protein Induces Abnormal Oligomerization via Allosteric Modulation Frontiers in Molecular Biosciences 9 (2022)
Hsu J, Chen J, Lin S, Hong J, Chen Y, Jeng U, Luo S, Hou M

R_g^Guinier	6.4	nm
D_max	22.0	nm
Volume^Porod	896	nm³

SASDNG6 – full-length MERS CoV N-protein complexed with 5-Isopropoxy-1H-indole (P4-2 compound)

Nucleoprotein5-Isopropoxy-1H-indole experimental SAS data

Sample:	Nucleoprotein dodecamer, 548 kDa Middle East respiratory … protein 5-Isopropoxy-1H-indole dodecamer, 2 kDa
Buffer:	50 mM Tris-HCl, 150 mM NaCl, pH: 8.5
Experiment:	SAXS data collected at 23A, Taiwan Photon Source, NSRRC on 2019 Nov 22

R_g^Guinier	6.4	nm
D_max	22.2	nm
Volume^Porod	911	nm³

SASDNH6 – full-length MERS CoV N-protein complexed with 5-(2-fluoroethoxy)-1H-indole (P4-3 compound)

Nucleoprotein5-(2-fluoroethoxy)-1H-indole experimental SAS data

Sample:	Nucleoprotein tetramer, 183 kDa Middle East respiratory … protein 5-(2-fluoroethoxy)-1H-indole tetramer, 1 kDa
Buffer:	50 mM Tris-HCl, 150 mM NaCl, pH: 8.5
Experiment:	SAXS data collected at 23A, Taiwan Photon Source, NSRRC on 2019 Nov 26

R_g^Guinier	5.7	nm
D_max	19.1	nm
Volume^Porod	477	nm³

SASDNJ6 – full-length MERS CoV N-protein complexed with 5-(2-methoxyethoxy)-1H-indole (P4-4 compound)

Nucleoprotein5-(2-methoxyethoxy)-1H-indole experimental SAS data

Sample:	Nucleoprotein tetramer, 183 kDa Middle East respiratory … protein 5-(2-methoxyethoxy)-1H-indole tetramer, 1 kDa
Buffer:	50 mM Tris-HCl, 150 mM NaCl, pH: 8.5
Experiment:	SAXS data collected at 23A, Taiwan Photon Source, NSRRC on 2019 Nov 26

R_g^Guinier	6.0	nm
D_max	18.5	nm
Volume^Porod	500	nm³

SASDHL8 – Aquifex aeolicus McoA metaloxidase evolved variant (2F4)

McoA evolved variant 2F4 (Periplasmic cell division protein (SufI)) experimental SAS data

Sample:	McoA evolved variant 2F4 (Periplasmic cell division protein (SufI)) monomer, 55 kDa Aquifex aeolicus VF5 protein
Buffer:	50 mM Tris-HCl, 150 mM NaCl, 2 mM TCEP, pH: 7.5
Experiment:	SAXS data collected at BM29, ESRF on 2017 Sep 25

Distal Mutations Shape Substrate-Binding Sites during Evolution of a Metallo-Oxidase into a Laccase ACS Catalysis :5022-5035 (2022)
Brissos V, Borges P, Núñez-Franco R, Lucas M, Frazão C, Monza E, Masgrau L, Cordeiro T, Martins L

R_g^Guinier	2.3	nm
D_max	6.8	nm
Volume^Porod	78	nm³

SASDHM8 – Aquifex aeolicus McoA metaloxidase ∆328-352 evolved variant (2F4∆328-352)

Aquifex aeolicus McoA metaloxidase ∆328-352 evolved variant (2F4∆328-352) experimental SAS data

Sample:	Aquifex aeolicus McoA metaloxidase ∆328-352 evolved variant (2F4∆328-352) monomer, 53 kDa Aquifex aeolicus protein
Buffer:	50 mM Tris-HCl, 150 mM NaCl, 2 mM TCEP, pH: 7.5
Experiment:	SAXS data collected at BM29, ESRF on 2018 Jul 18

R_g^Guinier	2.2	nm
D_max	6.6	nm
Volume^Porod	74	nm³

SASDLD2 – Circular permutant Carboxypeptidase G2-CP-N89-K177A

Carboxypeptidase G2 (circular permutant CP-N89) K177A experimental SAS data

Sample:	Carboxypeptidase G2 (circular permutant CP-N89) K177A dimer, 85 kDa Pseudomonas sp. (strain … protein
Buffer:	50 mM Tris, 100 mM NaCl, pH: 7.4
Experiment:	SAXS data collected at 12.3.1 (SIBYLS), Advanced Light Source (ALS) on 2017 Jun 6

Massively parallel, computationally guided design of a proenzyme. Proc Natl Acad Sci U S A 119(15):e2116097119 (2022)
Yachnin BJ, Azouz LR, White RE 3rd, Minetti CASA, Remeta DP, Tan VM, Drake JM, Khare SD

R_g^Guinier	3.6	nm
D_max	14.0	nm
Volume^Porod	105	nm³

SASDLE2 – Circular permutant Carboxypeptidase G2-CP-N89-K177A with methotrexate

Carboxypeptidase G2 (circular permutant CP-N89) K177AMethotrexate experimental SAS data

Sample:	Carboxypeptidase G2 (circular permutant CP-N89) K177A dimer, 85 kDa Pseudomonas sp. (strain … protein Methotrexate dimer, 1 kDa
Buffer:	50 mM Tris, 100 mM NaCl, pH: 7.4
Experiment:	SAXS data collected at 12.3.1 (SIBYLS), Advanced Light Source (ALS) on 2017 Jun 6

R_g^Guinier	3.5	nm
D_max	12.7	nm
Volume^Porod	104	nm³

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