C6 - 3D Structure - Screen Contents

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Supplemental Information

Screen Description

Molecular Dimensions / 3D Structure

Created 2009-11-16.

Rigaku Recipe XML

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Screen Structure

Well Count	48
Number of distinct ingredients	24
Internal diversity (Score mean dist)	0.92
Internal diversity (Ion mean dist)	0.9
Internal diversity (PEG mean dist)	0.89
Internal diversity (Known pH mean dist)	0.83
Internal diversity (Penalty mean dist)	0.9

Screen Composition

More information about screen composition chart.

Chemical classes bar chart — ingredient type 3D Structure

Buffer 58

Organic (non-volatile) 10

Organic (volatile) 2

Polymer 30

Salt 58

ingredient type	3D Structure
Buffer	58
Organic (non-volatile)	10
Organic (volatile)	2
Polymer	30
Salt	58

Well Contents

Buffers are shown in italics. More information about buffers.

Primary factors are shown in bold. More information about primary factors.

3D Structure Well Contents 🔍
Well	Ingredient, Concentration, Units, pH	pH	Recipe 1000μl
A1	2-methyl-2,4-pentanediol BCC 30 v/v - Calcium chloride 20 mM - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	300.0 μl of 2-methyl-2,4-pentanediol BCC (100 v/v) 200.0 μl of Calcium chloride (100 mM) 47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 400.0 μl of water (100 v/v)
A2	Polyethylene glycol 4,000 30 w/v - Ammonium acetate 0.2 M - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	200.0 μl of Ammonium acetate (1 M) 600.0 μl of Polyethylene glycol 4,000 (50 w/v) 47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 100.0 μl of water (100 v/v)
A3	Polyethylene glycol 4,000 25 w/v - Ammonium sulfate 0.2 M - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	57.14 μl of Ammonium sulfate (3.5 M) 500.0 μl of Polyethylene glycol 4,000 (50 w/v) 47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 342.86 μl of water (100 v/v)
A4	Sodium formate 2 M - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 285.71 μl of Sodium formate (7 M) 614.29 μl of water (100 v/v)
A5	Ammonium di-hydrogen phosphate 1 M - tri-Sodium citrate 0.1 M pH 5.6 🔍 ⚖️	pH 5.6	400.0 μl of Ammonium di-hydrogen phosphate (2.5 M) 11.61 μl of tri-Sodium citrate pH 3 (1.6 M) 50.89 μl of tri-Sodium citrate pH 6.5 (1.6 M) 537.5 μl of water (100 v/v)
A6	Polyethylene glycol 8,000 20 w/v - Magnesium acetate 0.2 M - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	200.0 μl of Magnesium acetate (1 M) 400.0 μl of Polyethylene glycol 8,000 (50 w/v) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 300.0 μl of water (100 v/v)
A7	2-methyl-2,4-pentanediol BCC 30 v/v - Magnesium acetate 0.2 M - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	300.0 μl of 2-methyl-2,4-pentanediol BCC (100 v/v) 200.0 μl of Magnesium acetate (1 M) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 400.0 μl of water (100 v/v)
A8	Polyethylene glycol 8,000 30 w/v - Sodium acetate 0.2 M - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	600.0 μl of Polyethylene glycol 8,000 (50 w/v) 66.67 μl of Sodium acetate (3 M) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 233.33 μl of water (100 v/v)
B1	Zinc acetate 0.2 M - Polyethylene glycol 8,000 18 w/v - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	360.0 μl of Polyethylene glycol 8,000 (50 w/v) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 200.0 μl of Zinc acetate (1 M) 340.0 μl of water (100 v/v)
B2	Polyethylene glycol 400 28 v/v - Calcium chloride 0.2 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of Calcium chloride (2 M) 100.0 μl of HEPES pH 7.5 (1 M) 280.0 μl of Polyethylene glycol 400 (100 v/v) 520.0 μl of water (100 v/v)
B3	Potassium Sodium phosphate 1.6 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of HEPES pH 7.5 (1 M) 533.33 μl of Potassium Sodium phosphate pH 7 (3 M) 366.67 μl of water (100 v/v)
B4	Lithium sulfate 1.5 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of HEPES pH 7.5 (1 M) 750.0 μl of Lithium sulfate (2 M) 150.0 μl of water (100 v/v)
B5	tri-Sodium citrate 1.4 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of HEPES pH 7.5 (1 M) 466.67 μl of tri-Sodium citrate (3 M) 433.33 μl of water (100 v/v)
B6	Ammonium sulfate 2 M - Polyethylene glycol 400 2 v/v - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	571.43 μl of Ammonium sulfate (3.5 M) 100.0 μl of HEPES pH 7.5 (1 M) 20.0 μl of Polyethylene glycol 400 (100 v/v) 308.57 μl of water (100 v/v)
B7	Polyethylene glycol 4,000 20 w/v - 2-Propanol 10 v/v - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of 2-Propanol (100 v/v) 100.0 μl of HEPES pH 7.5 (1 M) 400.0 μl of Polyethylene glycol 4,000 (50 w/v) 400.0 μl of water (100 v/v)
B8	Ammonium sulfate 2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	571.43 μl of Ammonium sulfate (3.5 M) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 328.57 μl of water (100 v/v)
C1	Polyethylene glycol 4,000 30 w/v - Magnesium chloride 0.2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	100.0 μl of Magnesium chloride (2 M) 600.0 μl of Polyethylene glycol 4,000 (50 w/v) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 200.0 μl of water (100 v/v)
C2	Polyethylene glycol 400 30 v/v - tri-Sodium citrate 0.2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	300.0 μl of Polyethylene glycol 400 (100 v/v) 66.67 μl of tri-Sodium citrate (3 M) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 533.33 μl of water (100 v/v)
C3	Polyethylene glycol 4,000 30 w/v - Lithium sulfate 0.2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	100.0 μl of Lithium sulfate (2 M) 600.0 μl of Polyethylene glycol 4,000 (50 w/v) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 200.0 μl of water (100 v/v)
C4	Polyethylene glycol 8,000 8 w/v - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	160.0 μl of Polyethylene glycol 8,000 (50 w/v) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 740.0 μl of water (100 v/v)
C5	Polyethylene glycol 8,000 30 w/v - Ammonium sulfate 0.2 M - 🔍 ⚖️	NA	57.14 μl of Ammonium sulfate (3.5 M) 600.0 μl of Polyethylene glycol 8,000 (50 w/v) 342.86 μl of water (100 v/v)
C6	Sodium formate 4 M - 🔍 ⚖️	NA	571.43 μl of Sodium formate (7 M) 428.57 μl of water (100 v/v)
C7	Potassium di-hydrogen phosphate 50 mM - Polyethylene glycol 8,000 20 w/v - 🔍 ⚖️	NA	400.0 μl of Polyethylene glycol 8,000 (50 w/v) 500.0 μl of Potassium di-hydrogen phosphate (100 mM) 100.0 μl of water (100 v/v)
C8	Polyethylene glycol 1,500 30 w/v - 🔍 ⚖️	NA	600.0 μl of Polyethylene glycol 1,500 (50 w/v) 400.0 μl of water (100 v/v)
D1	2-methyl-2,4-pentanediol BCC 21 v/v - Calcium chloride 20 mM - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	210.0 μl of 2-methyl-2,4-pentanediol BCC (100 v/v) 200.0 μl of Calcium chloride (100 mM) 47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 490.0 μl of water (100 v/v)
D2	Polyethylene glycol 4,000 21 w/v - Ammonium acetate 0.2 M - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	200.0 μl of Ammonium acetate (1 M) 420.0 μl of Polyethylene glycol 4,000 (50 w/v) 47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 280.0 μl of water (100 v/v)
D3	Polyethylene glycol 4,000 17.5 w/v - Ammonium sulfate 0.2 M - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	57.14 μl of Ammonium sulfate (3.5 M) 350.0 μl of Polyethylene glycol 4,000 (50 w/v) 47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 492.86 μl of water (100 v/v)
D4	Sodium formate 1.4 M - Sodium acetate 0.1 M pH 4.6 🔍 ⚖️	pH 4.6	47.5 μl of Sodium acetate pH 4 (1 M) 52.5 μl of Sodium acetate pH 5 (1 M) 200.0 μl of Sodium formate (7 M) 700.0 μl of water (100 v/v)
D5	Ammonium di-hydrogen phosphate 0.7 M - tri-Sodium citrate 0.1 M pH 5.6 🔍 ⚖️	pH 5.6	280.0 μl of Ammonium di-hydrogen phosphate (2.5 M) 11.61 μl of tri-Sodium citrate pH 3 (1.6 M) 50.89 μl of tri-Sodium citrate pH 6.5 (1.6 M) 657.5 μl of water (100 v/v)
D6	Polyethylene glycol 8,000 14 w/v - Magnesium acetate 0.2 M - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	200.0 μl of Magnesium acetate (1 M) 280.0 μl of Polyethylene glycol 8,000 (50 w/v) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 420.0 μl of water (100 v/v)
D7	2-methyl-2,4-pentanediol BCC 21 v/v - Magnesium acetate 0.2 M - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	210.0 μl of 2-methyl-2,4-pentanediol BCC (100 v/v) 200.0 μl of Magnesium acetate (1 M) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 490.0 μl of water (100 v/v)
D8	Polyethylene glycol 8,000 21 w/v - Sodium acetate 0.2 M - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	420.0 μl of Polyethylene glycol 8,000 (50 w/v) 66.67 μl of Sodium acetate (3 M) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 413.33 μl of water (100 v/v)
E1	Zinc acetate 0.2 M - Polyethylene glycol 8,000 12.6 w/v - Sodium cacodylate 0.1 M pH 6.5 🔍 ⚖️	pH 6.5	252.0 μl of Polyethylene glycol 8,000 (50 w/v) 100.0 μl of Sodium cacodylate pH 6.5 (1 M) 200.0 μl of Zinc acetate (1 M) 448.0 μl of water (100 v/v)
E2	Polyethylene glycol 400 19.6 v/v - Calcium chloride 0.2 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of Calcium chloride (2 M) 100.0 μl of HEPES pH 7.5 (1 M) 196.0 μl of Polyethylene glycol 400 (100 v/v) 604.0 μl of water (100 v/v)
E3	Potassium Sodium phosphate 1.12 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of HEPES pH 7.5 (1 M) 373.33 μl of Potassium Sodium phosphate pH 7 (3 M) 526.67 μl of water (100 v/v)
E4	Lithium sulfate 1.05 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of HEPES pH 7.5 (1 M) 525.0 μl of Lithium sulfate (2 M) 375.0 μl of water (100 v/v)
E5	tri-Sodium citrate 0.98 M - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	100.0 μl of HEPES pH 7.5 (1 M) 326.67 μl of tri-Sodium citrate (3 M) 573.33 μl of water (100 v/v)
E6	Ammonium sulfate 2 M - Polyethylene glycol 400 1.4 v/v - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	571.43 μl of Ammonium sulfate (3.5 M) 100.0 μl of HEPES pH 7.5 (1 M) 14.0 μl of Polyethylene glycol 400 (100 v/v) 314.57 μl of water (100 v/v)
E7	Polyethylene glycol 4,000 20 w/v - 2-Propanol 7 v/v - HEPES 0.1 M pH 7.5 🔍 ⚖️	pH 7.5	70.0 μl of 2-Propanol (100 v/v) 100.0 μl of HEPES pH 7.5 (1 M) 400.0 μl of Polyethylene glycol 4,000 (50 w/v) 430.0 μl of water (100 v/v)
E8	Ammonium sulfate 1.4 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	400.0 μl of Ammonium sulfate (3.5 M) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 500.0 μl of water (100 v/v)
F1	Polyethylene glycol 4,000 21 w/v - Magnesium chloride 0.2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	100.0 μl of Magnesium chloride (2 M) 420.0 μl of Polyethylene glycol 4,000 (50 w/v) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 380.0 μl of water (100 v/v)
F2	Polyethylene glycol 400 21 v/v - tri-Sodium citrate 0.2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	210.0 μl of Polyethylene glycol 400 (100 v/v) 66.67 μl of tri-Sodium citrate (3 M) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 623.33 μl of water (100 v/v)
F3	Polyethylene glycol 4,000 21 w/v - Lithium sulfate 0.2 M - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	100.0 μl of Lithium sulfate (2 M) 420.0 μl of Polyethylene glycol 4,000 (50 w/v) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 380.0 μl of water (100 v/v)
F4	Polyethylene glycol 8,000 5.6 w/v - tris chloride BCC 0.1 M pH 8.5 🔍 ⚖️	pH 8.5	112.0 μl of Polyethylene glycol 8,000 (50 w/v) 100.0 μl of tris chloride BCC pH 8.5 (1 M) 788.0 μl of water (100 v/v)
F5	Polyethylene glycol 8,000 21 w/v - Ammonium sulfate 0.2 M - 🔍 ⚖️	NA	57.14 μl of Ammonium sulfate (3.5 M) 420.0 μl of Polyethylene glycol 8,000 (50 w/v) 522.86 μl of water (100 v/v)
F6	Sodium formate 2.8 M - 🔍 ⚖️	NA	400.0 μl of Sodium formate (7 M) 600.0 μl of water (100 v/v)
F7	Potassium di-hydrogen phosphate 50 mM - Polyethylene glycol 8,000 14 w/v - 🔍 ⚖️	NA	280.0 μl of Polyethylene glycol 8,000 (50 w/v) 500.0 μl of Potassium di-hydrogen phosphate (100 mM) 220.0 μl of water (100 v/v)
F8	Polyethylene glycol 1,500 21 w/v - 🔍 ⚖️	NA	420.0 μl of Polyethylene glycol 1,500 (50 w/v) 580.0 μl of water (100 v/v)