Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8f7b6763048478bf66bfc10e150cc4e8",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 96.69,
"b": 139.24,
"c": 68.80,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97892],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [139.240,2.820],
"number_observations": 184329,
"number_observations_unique": 22776,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 15.800
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 8.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.970,2.820],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.381
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 7.700
}
]
},
{
"resolution_limits": [3.150,2.970],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.270
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 7.800
}
]
},
{
"resolution_limits": [3.370,3.150],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 7.700
}
]
},
{
"resolution_limits": [3.640,3.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 7.800
}
]
},
{
"resolution_limits": [3.990,3.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 6.800
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 7.800
}
]
},
{
"resolution_limits": [4.460,3.990],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.900
}
]
},
{
"resolution_limits": [5.150,4.460],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 7.600
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 8.300
}
]
},
{
"resolution_limits": [6.310,5.150],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 8.700
}
]
},
{
"resolution_limits": [8.920,6.310],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 18.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.200
}
]
},
{
"resolution_limits": [56.057,8.920],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 15.600
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 9.300
}
]
}
]
}