Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "35f3bf5065c12e98ed374588d4dda6de",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 63.81,
"b": 75.46,
"c": 121.20,
"alpha": 90.00,
"beta": 98.01,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [120.066,2.060],
"number_observations_unique": 65704,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 5.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.170,2.060],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.490
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 84.900
},
{
"type": "Redundancy",
"value": 5.500
}
]
},
{
"resolution_limits": [2.300,2.170],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.424
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 88.300
},
{
"type": "Redundancy",
"value": 5.300
}
]
},
{
"resolution_limits": [2.460,2.300],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.354
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 90.800
},
{
"type": "Redundancy",
"value": 5.300
}
]
},
{
"resolution_limits": [2.660,2.460],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.278
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 93.300
},
{
"type": "Redundancy",
"value": 5.300
}
]
},
{
"resolution_limits": [2.910,2.660],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.239
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 5.400
}
]
},
{
"resolution_limits": [3.260,2.910],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.209
},
{
"type": "I/SigI",
"value": 3.100
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 5.600
}
]
},
{
"resolution_limits": [3.760,3.260],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "I/SigI",
"value": 3.400
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 6.000
}
]
},
{
"resolution_limits": [4.610,3.760],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.700
}
]
},
{
"resolution_limits": [6.510,4.610],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "I/SigI",
"value": 4.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.100
}
]
},
{
"resolution_limits": [36.025,6.510],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 8.400
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 6.800
}
]
}
]
}